data_2rpr_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 2rpr _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 11' ' ' LEU . . . . . 0.48 ' H ' ' CE1' ' A' ' 61' ' ' HIS . 16.4 tp . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.799 0.333 . . . . 74.200000000000003 110.888 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -106.19 150.24 26.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 61.130000000000003 110.875 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -137.81 172.47 12.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 71.409999999999997 110.807 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.452 HD13 ' CG2' ' A' ' 24' ' ' VAL . 8.5 mt -142.11 157.53 44.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.065 -0.516 . . . . 74.140000000000001 110.883 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 70.409999999999997 110.875 179.887 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.836 0.351 . . . . 63.240000000000002 110.904 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -99.49 167.88 10.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 73.129999999999995 110.927 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tp -129.43 125.98 37.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 73.040000000000006 110.951 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.452 ' CG2' HD13 ' A' ' 14' ' ' LEU . 77.6 t -95.38 116.57 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 71.209999999999994 111.119 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.534 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 9.0 t60 -154.77 126.08 7.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 73.150000000000006 110.902 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 63.89 38.51 8.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 73.420000000000002 110.847 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.1 m 58.55 24.61 12.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 71.239999999999995 110.858 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -121.52 -177.3 3.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.115 -0.493 . . . . 74.409999999999997 110.887 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.401 HD23 ' CD1' ' A' ' 78' ' ' LEU . 69.8 mt -132.76 132.98 42.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.093 -0.503 . . . . 64.109999999999999 110.935 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.499 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -127.63 170.07 13.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.175 -0.466 . . . . 74.120000000000005 110.888 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.446 ' NE ' ' HB2' ' A' ' 45' ' ' ARG . 20.3 mtt180 -131.18 137.09 48.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 71.430000000000007 110.83 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.45 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 37.6 tttt -64.42 110.52 2.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 73.439999999999998 110.9 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -82.66 -59.25 2.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 74.519999999999996 110.888 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.482 ' HE2' ' CD2' ' A' ' 41' ' ' TYR . 10.1 pttm -142.81 177.87 8.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 74.239999999999995 110.852 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -142.79 120.8 12.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.245 -0.434 . . . . 73.329999999999998 111.098 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.85 32.68 0.8 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 74.120000000000005 111.1 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.07 -60.31 4.91 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.753 -0.737 . . . . 73.040000000000006 112.508 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -105.79 -13.04 15.66 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.864 0.364 . . . . 74.230000000000004 110.859 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.437 ' HG2' ' CG ' ' A' ' 59' ' ' GLN . 36.2 mtmt -121.24 148.36 44.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.158 -0.474 . . . . 74.329999999999998 110.877 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.41 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 3.5 t -125.76 111.12 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 72.400000000000006 111.152 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.482 ' CD2' ' HE2' ' A' ' 34' ' ' LYS . 3.6 m-85 -79.72 141.77 36.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 73.219999999999999 110.928 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.45 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 63.6 m95 -130.29 166.28 20.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.033 -0.53 . . . . 75.409999999999997 110.938 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.0 ptt? -146.75 135.49 22.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 70.340000000000003 110.879 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.9 t -50.16 109.6 0.31 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 63.43 110.869 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.446 ' HB2' ' NE ' ' A' ' 31' ' ' ARG . 39.1 ptt85 -44.48 -23.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 74.430000000000007 110.923 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.47 30.86 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 61.329999999999998 110.856 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -82.01 -26.11 34.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 75.019999999999996 110.913 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.04 -23.56 16.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 71.310000000000002 111.17 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.0 tpp85 -96.7 -60.56 1.58 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.477 . . . . 73.319999999999993 110.86 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 mt -94.34 22.79 5.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 74.409999999999997 110.889 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 38.08 41.88 1.08 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.742 -0.742 . . . . 63.210000000000001 112.486 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.2 t -90.26 120.76 31.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.907 0.384 . . . . 70.099999999999994 110.814 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -99.3 13.33 33.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 73.299999999999997 110.862 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.7 t -65.03 117.74 8.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 64.239999999999995 110.874 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -114.87 159.4 20.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 75.219999999999999 110.917 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.462 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -144.74 164.45 30.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 71.319999999999993 111.097 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 64' ' ' MET . 69.1 mt -127.25 129.23 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.319999999999993 111.124 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.418 HG23 ' CD1' ' A' ' 42' ' ' TRP . 42.2 p -110.36 136.84 48.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 73.040000000000006 111.156 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.437 ' CG ' ' HG2' ' A' ' 39' ' ' LYS . 4.7 mt-30 -144.48 116.23 8.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 74.120000000000005 110.945 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 70.19 -99.2 0.69 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.71 -0.757 . . . . 64.200000000000003 112.535 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.48 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -128.26 4.84 5.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.763 0.316 . . . . 75.010000000000005 110.803 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 42.5 mtm180 -107.01 -175.22 2.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.209999999999994 110.817 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.47 HD13 ' CD2' ' A' ' 25' ' ' HIS . 21.3 tt -150.81 162.75 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 73.340000000000003 111.074 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.462 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 3.9 mpp? -141.6 147.66 37.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.108 -0.496 . . . . 74.409999999999997 110.864 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.534 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 43.7 t -116.76 130.13 72.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 74.049999999999997 111.121 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 19.4 mtp -89.42 -64.08 1.19 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.211 -0.449 . . . . 74.129999999999995 110.852 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.9 ttm180 -112.34 175.93 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.268 -0.424 . . . . 74.129999999999995 110.901 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.4 p -90.99 -176.18 4.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 75.319999999999993 110.909 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -114.17 137.71 51.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 74.040000000000006 110.889 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.3 t -93.27 13.88 19.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.234 -0.439 . . . . 71.420000000000002 110.839 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 26.7 p80 -141.48 169.29 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 74.310000000000002 110.866 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.441 ' CD ' ' N ' ' A' ' 72' ' ' GLN . 1.8 mp0 -102.57 151.79 38.29 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.576 0.703 . . . . 73.0 110.92 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.88 149.6 66.32 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.639 2.226 . . . . 63.329999999999998 112.347 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -124.76 81.14 1.92 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 75.540000000000006 110.816 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.5 mt -48.75 -22.9 0.88 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 75.200000000000003 110.919 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -75.24 -41.33 57.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.400000000000006 111.103 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -80.68 -31.38 36.59 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.724 -0.75 . . . . 71.420000000000002 112.486 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.401 ' CD1' HD23 ' A' ' 29' ' ' LEU . 9.6 tp -68.72 -38.31 80.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.707 0.289 . . . . 73.329999999999998 110.891 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -70.3 -34.72 73.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.187 -0.46 . . . . 75.329999999999998 110.896 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.93 -20.09 66.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 73.420000000000002 111.062 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.0 mt -90.15 -21.92 21.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 73.540000000000006 110.888 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 28.9 mtt180 . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 74.340000000000003 110.877 179.965 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.554 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 14.5 tp . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.735 0.302 . . . . 74.239999999999995 110.931 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.449 ' C ' ' CD1' ' A' ' 13' ' ' PHE . 34.0 tt0 -113.52 145.73 40.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 72.510000000000005 110.911 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.554 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 0.8 OUTLIER -140.0 167.9 21.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 75.400000000000006 110.898 -179.925 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.415 ' CD2' ' HG2' ' A' ' 82' ' ' ARG . 8.9 mt -137.57 117.53 13.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.140000000000001 111.012 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 72.209999999999994 110.903 179.953 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.811 0.339 . . . . 73.310000000000002 110.833 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -110.95 164.27 12.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 73.010000000000005 110.909 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.4 tp -129.16 113.68 15.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 74.540000000000006 110.962 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -88.01 112.08 23.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 74.530000000000001 111.11 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.575 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 9.2 t60 -149.27 125.49 10.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.151 -0.477 . . . . 72.439999999999998 110.821 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 63.21 42.96 6.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.24 -0.436 . . . . 75.409999999999997 110.904 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.7 m 56.05 19.94 4.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 65.120000000000005 110.902 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -116.83 -175.42 2.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.016 -0.538 . . . . 74.040000000000006 110.915 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.5 mt -136.61 133.6 36.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.161 -0.472 . . . . 71.340000000000003 110.922 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.515 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -129.23 163.06 26.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 74.239999999999995 110.914 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.8 mtp180 -124.77 139.88 53.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 71.200000000000003 110.928 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.8 tttt -60.91 116.18 4.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 74.319999999999993 110.898 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -91.97 -57.57 2.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 75.209999999999994 110.904 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.7 pttt -151.32 168.48 24.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 73.25 110.924 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -132.7 119.19 20.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 73.530000000000001 111.09 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -82.54 38.01 0.54 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 74.340000000000003 111.067 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.21 -50.59 4.0 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.755 -0.736 . . . . 74.420000000000002 112.5 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -114.44 -27.81 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.908 0.385 . . . . 54.520000000000003 110.878 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -104.61 154.81 19.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 74.319999999999993 110.883 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 t -127.87 111.97 26.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.275 -0.421 . . . . 74.230000000000004 111.102 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.463 ' CZ ' HD13 ' A' ' 57' ' ' ILE . 3.4 m-85 -79.45 145.27 33.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 64.319999999999993 110.893 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.434 ' N ' ' O ' ' A' ' 56' ' ' ALA . 66.5 m95 -135.3 163.14 30.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.117 -0.492 . . . . 73.140000000000001 110.875 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.9 ptt? -145.79 132.06 19.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 71.019999999999996 110.909 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.406 ' C ' ' N ' ' A' ' 46' ' ' ASP . 1.8 t -46.1 108.46 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 75.329999999999998 110.813 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -43.49 -23.65 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 70.349999999999994 110.858 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.406 ' N ' ' C ' ' A' ' 44' ' ' CYS . 3.3 m-20 -81.39 42.06 0.65 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 71.349999999999994 110.822 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -85.8 -36.09 20.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 75.25 110.934 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.89 -14.57 20.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 75.230000000000004 111.128 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -98.91 -53.71 3.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 71.200000000000003 110.914 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.447 ' O ' ' C ' ' A' ' 51' ' ' GLY . 33.9 mt -108.01 27.34 9.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.201 -0.454 . . . . 74.319999999999993 110.903 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.447 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.63 47.08 0.61 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.761 -0.733 . . . . 70.409999999999997 112.484 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.3 t -97.59 142.71 29.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.759 0.314 . . . . 54.020000000000003 110.895 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.422 ' HD2' ' N ' ' A' ' 53' ' ' ARG . 0.4 OUTLIER -118.37 -0.87 11.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.172 -0.467 . . . . 74.140000000000001 110.926 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.555 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . 1.1 t -52.43 116.13 2.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.205 -0.452 . . . . 64.030000000000001 110.862 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.6 mtm105 -111.14 171.16 7.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 75.209999999999994 110.819 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.476 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -160.68 151.32 18.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 74.420000000000002 111.092 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.492 ' O ' ' N ' ' A' ' 64' ' ' MET . 23.0 mt -115.49 130.16 70.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 74.219999999999999 111.099 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.3 p -111.32 141.47 44.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 72.439999999999998 111.156 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -146.72 109.3 4.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 75.25 110.9 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 75.29 -95.95 0.98 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.718 -0.753 . . . . 72.420000000000002 112.448 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -129.03 1.18 5.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.804 0.335 . . . . 73.420000000000002 110.818 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.7 mmm-85 -102.79 -176.41 3.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 74.129999999999995 110.894 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.534 HD11 ' CD2' ' A' ' 25' ' ' HIS . 20.4 tt -150.4 161.97 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.199 -0.455 . . . . 74.310000000000002 111.158 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.492 ' N ' ' O ' ' A' ' 57' ' ' ILE . 16.8 ttm -138.62 141.28 39.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 74.409999999999997 110.933 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.575 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 55.2 t -106.41 133.25 51.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 73.140000000000001 111.129 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 23.5 mmt -93.87 -65.1 1.01 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 74.120000000000005 110.956 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -119.5 -178.27 3.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 63.530000000000001 110.903 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 77.3 p -91.82 -175.36 4.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 73.019999999999996 110.895 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.555 ' CE1' ' HB3' ' A' ' 54' ' ' SER . 75.8 m-70 -117.84 144.09 45.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 64.200000000000003 110.896 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 90.0 m -97.07 11.2 37.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 72.030000000000001 110.873 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.434 ' CG ' HD12 ' A' ' 50' ' ' LEU . 28.6 p80 -139.08 166.28 24.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 72.310000000000002 110.873 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -97.7 152.29 38.06 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.569 0.699 . . . . 75.140000000000001 110.953 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.71 160.31 50.2 Favored 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 122.755 2.303 . . . . 74.400000000000006 112.264 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.24 93.48 2.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.115 -0.493 . . . . 75.519999999999996 110.841 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.497 ' CD2' ' N ' ' A' ' 75' ' ' LEU . 0.5 OUTLIER -60.99 -22.18 64.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 74.239999999999995 110.93 -179.93 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.2 -55.38 9.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 75.420000000000002 111.124 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.22 -29.1 74.29 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.687 -0.768 . . . . 73.230000000000004 112.536 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 10.9 tp -77.33 -48.59 16.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.788 0.327 . . . . 73.439999999999998 110.896 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -64.19 -25.0 67.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 74.420000000000002 110.849 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.44 -25.73 63.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 74.420000000000002 111.121 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mt -79.12 -49.63 12.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.166 -0.47 . . . . 65.340000000000003 110.915 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.415 ' HG2' ' CD2' ' A' ' 14' ' ' LEU . 19.8 mtm180 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.481 . . . . 73.439999999999998 110.907 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.528 HD21 ' CZ ' ' A' ' 13' ' ' PHE . 15.8 tp . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.781 0.324 . . . . 73.409999999999997 110.875 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -106.42 151.04 25.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 75.510000000000005 110.85 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.528 ' CZ ' HD21 ' A' ' 11' ' ' LEU . 48.9 m-85 -139.98 170.52 15.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 75.450000000000003 110.866 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.5 mt -143.89 162.25 36.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 72.140000000000001 110.936 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.7 mtt85 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 75.349999999999994 110.896 179.93 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.803 0.335 . . . . 73.519999999999996 110.899 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -116.04 165.29 13.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 75.239999999999995 110.904 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.6 tp -131.71 117.59 18.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 75.299999999999997 110.86 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.5 t -93.55 111.7 25.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.453 . . . . 75.540000000000006 111.101 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.548 ' CD2' HD13 ' A' ' 63' ' ' ILE . 57.5 t60 -147.98 132.61 17.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 74.049999999999997 110.832 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.415 ' HG3' ' NE2' ' A' ' 25' ' ' HIS . 23.6 mt-10 59.6 35.58 22.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 74.230000000000004 110.892 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m 63.43 29.32 15.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 75.040000000000006 110.909 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.542 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 22.1 m-85 -130.72 -178.17 4.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 70.340000000000003 110.91 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 16.2 mt -133.38 133.15 42.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 72.5 110.913 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.495 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.2 m-85 -125.71 161.51 27.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 60.229999999999997 110.919 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.476 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 3.3 mtt-85 -115.63 126.35 54.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 72.400000000000006 110.822 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.513 ' HB2' ' CH2' ' A' ' 42' ' ' TRP . 15.6 ttpt -57.45 110.07 0.8 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.451 . . . . 73.409999999999997 110.86 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -82.38 -58.14 3.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 74.430000000000007 110.891 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.1 pttp -149.88 -176.66 5.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 64.439999999999998 110.88 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.58 117.17 7.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 65.519999999999996 111.173 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.34 80.23 4.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 73.450000000000003 111.098 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.68 -78.14 0.37 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.717 -0.754 . . . . 64.409999999999997 112.503 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -116.19 -13.8 11.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.963 0.411 . . . . 74.430000000000007 110.938 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -94.08 149.64 21.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.114 -0.494 . . . . 75.430000000000007 110.937 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 1.7 t -132.55 118.99 37.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 75.239999999999995 111.126 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -87.49 134.22 33.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 74.450000000000003 110.898 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.513 ' CH2' ' HB2' ' A' ' 32' ' ' LYS . 68.5 m95 -124.32 168.17 13.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 75.310000000000002 110.893 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -152.86 133.54 13.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.246 -0.434 . . . . 75.540000000000006 110.866 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -42.89 111.02 0.22 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.43 . . . . 73.310000000000002 110.888 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.476 ' HB2' ' CZ ' ' A' ' 31' ' ' ARG . 37.0 ptt85 -52.36 -19.32 2.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 75.150000000000006 110.844 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.16 10.81 3.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.181 -0.463 . . . . 75.129999999999995 110.895 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 2.4 pp0? -68.75 -8.41 42.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 71.25 110.88 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.81 -43.95 7.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 72.319999999999993 111.067 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -93.38 -47.83 6.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 63.109999999999999 110.848 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.432 HD12 ' CD2' ' A' ' 71' ' ' HIS . 29.5 mt -88.93 -12.48 41.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 74.310000000000002 110.922 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 70.59 -0.51 26.51 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.789 -0.72 . . . . 71.430000000000007 112.484 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.403 ' O ' ' CB ' ' A' ' 47' ' ' GLN . 32.9 t -47.2 144.76 2.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.824 0.345 . . . . 60.340000000000003 110.884 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -125.07 19.29 8.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 72.439999999999998 110.895 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.419 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . 32.3 t -66.86 111.64 3.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 75.109999999999999 110.862 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -109.98 145.19 37.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 74.439999999999998 110.934 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.449 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -137.37 154.93 49.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.22 -0.445 . . . . 64.239999999999995 111.029 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.437 ' O ' ' N ' ' A' ' 64' ' ' MET . 75.7 mt -111.33 135.12 51.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 74.5 111.103 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.6 p -117.84 128.76 55.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 64.450000000000003 111.18 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -131.81 95.1 3.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 75.209999999999994 110.85 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 87.4 -95.44 2.08 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.74 -0.743 . . . . 65.340000000000003 112.502 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -127.09 0.23 6.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.797 0.332 . . . . 72.310000000000002 110.882 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.3 mmm-85 -104.18 -179.26 3.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 74.310000000000002 110.814 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.548 HD13 ' CD2' ' A' ' 25' ' ' HIS . 17.6 tt -150.3 160.57 4.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 75.340000000000003 111.147 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.449 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 4.5 mpp? -137.65 140.99 41.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 71.450000000000003 110.896 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 92.6 t -102.7 127.9 56.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 73.140000000000001 111.113 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.7 mtm -105.16 -16.59 14.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 110.865 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -154.49 160.28 41.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 75.409999999999997 110.851 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 88.2 p -90.09 179.25 5.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 62.439999999999998 110.831 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.486 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 38.4 m-70 -116.5 134.28 55.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.089 -0.505 . . . . 73.109999999999999 110.881 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 45.4 t -85.85 4.94 34.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 64.040000000000006 110.854 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.432 ' CD2' HD12 ' A' ' 50' ' ' LEU . 28.2 p80 -131.6 163.97 26.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.454 . . . . 74.430000000000007 110.869 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -100.82 149.21 35.99 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.617 0.722 . . . . 74.239999999999995 110.898 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.542 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 54.3 Cg_endo -69.71 156.47 63.39 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.692 2.261 . . . . 62.340000000000003 112.395 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.93 95.69 3.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.233 -0.439 . . . . 71.400000000000006 110.885 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mt -57.06 -14.82 4.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 64.319999999999993 110.924 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -74.47 -46.26 40.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.249 -0.432 . . . . 72.120000000000005 111.148 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.67 -31.57 40.11 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.686 -0.768 . . . . 62.420000000000002 112.508 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -70.66 -42.49 70.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.786 0.327 . . . . 64.510000000000005 110.964 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -64.56 -35.76 82.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 71.519999999999996 110.934 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.37 -37.98 79.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 72.150000000000006 111.083 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.3 mt -69.94 -22.58 63.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.272 -0.422 . . . . 75.329999999999998 110.916 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 35.7 mtt180 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 72.239999999999995 110.891 179.894 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.434 HD22 ' CZ ' ' A' ' 13' ' ' PHE . 11.1 tp . . . . . 0 N--CA 1.458 -0.067 0 CA-C-O 120.788 0.328 . . . . 74.439999999999998 110.892 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.406 ' CD ' ' NH1' ' A' ' 82' ' ' ARG . 24.8 tt0 -104.51 144.45 31.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 74.319999999999993 110.916 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.488 ' CE2' HD13 ' A' ' 23' ' ' LEU . 20.4 m-85 -140.03 171.92 13.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 65.219999999999999 110.85 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.42 HD12 ' CG2' ' A' ' 24' ' ' VAL . 6.2 mt -144.21 155.82 44.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 73.140000000000001 110.973 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 73.420000000000002 110.822 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.91 0.386 . . . . 74.519999999999996 110.822 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -129.26 158.6 38.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 75.319999999999993 110.868 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.488 HD13 ' CE2' ' A' ' 13' ' ' PHE . 11.1 tp -123.18 116.12 22.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 73.340000000000003 110.897 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.42 ' CG2' HD12 ' A' ' 14' ' ' LEU . 57.7 t -90.53 116.19 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 75.120000000000005 111.152 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.778 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 10.5 t60 -152.29 126.73 9.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 71.019999999999996 110.874 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 62.29 42.79 8.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.26 -0.427 . . . . 63.340000000000003 110.914 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.7 m 55.22 27.73 10.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.487 . . . . 73.430000000000007 110.847 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -125.99 -176.49 3.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 74.109999999999999 110.893 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 19.4 mt -135.33 131.99 37.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 73.230000000000004 110.895 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.515 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -126.7 168.77 13.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.473 . . . . 75.219999999999999 110.968 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -127.97 138.92 52.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 72.310000000000002 110.888 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.501 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 33.6 tttp -63.2 112.38 2.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 74.140000000000001 110.936 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -86.73 -58.39 2.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 72.439999999999998 110.921 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.411 ' NZ ' ' CD2' ' A' ' 41' ' ' TYR . 18.5 pttm -146.88 -177.58 5.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.145 -0.48 . . . . 74.230000000000004 110.864 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -144.41 121.83 11.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 75.430000000000007 111.184 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.5 51.11 2.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 73.549999999999997 111.121 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.94 -59.8 3.05 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.799 -0.715 . . . . 64.219999999999999 112.501 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.413 ' CD ' ' N ' ' A' ' 38' ' ' GLU . 13.5 mp0 -112.91 -30.19 7.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.896 0.379 . . . . 75.140000000000001 110.861 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -94.1 153.77 17.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 74.219999999999999 110.872 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.2 t -129.24 115.34 35.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.267 -0.424 . . . . 74.340000000000003 111.144 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.494 ' CZ ' HD13 ' A' ' 57' ' ' ILE . 3.0 m-85 -80.76 144.21 32.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 73.099999999999994 110.898 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.501 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 72.0 m95 -135.04 163.22 30.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 74.409999999999997 110.902 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.9 ptt? -148.19 131.59 16.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 73.340000000000003 110.932 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.0 t -42.31 115.31 0.67 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.289 -0.414 . . . . 71.25 110.812 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 39.4 ptt85 -50.5 -18.96 0.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 73.400000000000006 110.886 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.425 ' HB3' ' CD1' ' A' ' 50' ' ' LEU . 6.2 m-20 -88.26 32.06 0.78 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.461 . . . . 74.430000000000007 110.87 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.54 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -84.6 -14.53 48.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 73.0 110.865 -179.891 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.04 -46.3 6.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 75.25 111.133 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.1 ttt180 -84.48 -55.23 4.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.196 -0.456 . . . . 75.340000000000003 110.82 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.544 HD12 ' CD2' ' A' ' 71' ' ' HIS . 64.6 mt -88.07 9.56 22.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.289 -0.414 . . . . 74.530000000000001 110.957 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.8 35.48 2.18 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.746 -0.74 . . . . 70.109999999999999 112.47 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.412 ' N ' ' HA ' ' A' ' 47' ' ' GLN . 32.2 t -78.5 125.52 29.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.787 0.327 . . . . 71.120000000000005 110.878 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.65 19.31 18.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 75.140000000000001 110.863 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.7 t -69.64 125.67 27.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 64.340000000000003 110.855 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -122.48 159.52 27.48 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.164 -0.471 . . . . 65.129999999999995 110.91 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -151.74 149.48 29.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 41.520000000000003 111.075 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.494 HD13 ' CZ ' ' A' ' 41' ' ' TYR . 61.4 mt -117.7 131.08 71.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 74.109999999999999 111.139 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.1 p -115.66 144.69 43.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 64.239999999999995 111.217 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -130.39 94.66 3.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 72.120000000000005 110.96 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 78.55 -85.65 1.15 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.78 -0.724 . . . . 74.129999999999995 112.489 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -128.07 5.29 5.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.768 0.318 . . . . 72.099999999999994 110.854 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -102.8 176.98 4.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.206 -0.452 . . . . 73.450000000000003 110.835 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.552 HD11 ' CD2' ' A' ' 25' ' ' HIS . 18.3 tt -150.79 149.82 13.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.126 -0.488 . . . . 74.200000000000003 111.115 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.444 ' N ' ' O ' ' A' ' 57' ' ' ILE . 53.7 mtm -138.27 140.12 39.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 75.120000000000005 110.862 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.778 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 66.8 t -99.43 142.21 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 71.209999999999994 111.101 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 29.0 mmm -103.4 -62.25 1.31 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 65.230000000000004 110.926 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 -114.99 -175.75 2.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.305 -0.407 . . . . 75.109999999999999 110.882 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.7 p -96.91 -175.57 3.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 74.239999999999995 110.892 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.453 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 69.5 m-70 -117.74 135.31 54.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 71.230000000000004 110.866 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.3 t -90.1 14.94 11.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 74.340000000000003 110.927 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.544 ' CD2' HD12 ' A' ' 50' ' ' LEU . 25.2 p80 -143.36 162.29 36.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 75.329999999999998 110.829 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -93.59 152.84 41.17 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.645 0.736 . . . . 71.329999999999998 110.874 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 154.92 67.18 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.702 2.268 . . . . 72.299999999999997 112.375 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.26 82.34 2.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 75.140000000000001 110.897 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.1 mt -53.79 -16.32 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 74.430000000000007 110.906 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.05 -52.6 13.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 73.519999999999996 111.102 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.9 -30.11 64.03 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.666 -0.778 . . . . 65.299999999999997 112.442 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.6 tp -73.03 -46.06 54.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.86 0.362 . . . . 75.439999999999998 110.922 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.57 -36.51 78.67 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.216 -0.447 . . . . 65.420000000000002 110.837 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.47 -32.11 66.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 70.400000000000006 111.115 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.6 mt -73.57 -42.69 61.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 74.420000000000002 110.903 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.406 ' NH1' ' CD ' ' A' ' 12' ' ' GLU . 1.6 mpp_? . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 71.540000000000006 110.865 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.445 ' H ' ' CE1' ' A' ' 61' ' ' HIS . 11.7 tp . . . . . 0 CA--C 1.526 0.051 0 CA-C-O 120.846 0.355 . . . . 72.230000000000004 110.853 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -104.47 136.24 44.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.131 -0.486 . . . . 65.230000000000004 110.902 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -126.85 163.4 23.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 73.239999999999995 110.904 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.444 HD12 ' CG2' ' A' ' 24' ' ' VAL . 1.4 mt -148.9 153.31 37.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.136 -0.483 . . . . 71.120000000000005 110.893 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 ppt_? . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 73.150000000000006 110.84 179.954 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.1 tpp180 . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.738 0.304 . . . . 73.25 110.916 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -99.0 168.93 9.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 75.430000000000007 110.914 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.431 HD22 ' CG ' ' A' ' 42' ' ' TRP . 7.9 tp -123.85 114.13 19.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.112 -0.494 . . . . 72.430000000000007 110.894 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.444 ' CG2' HD12 ' A' ' 14' ' ' LEU . 43.0 t -90.74 110.75 22.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.45 . . . . 75.239999999999995 111.106 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.562 ' CD2' HD11 ' A' ' 63' ' ' ILE . 32.6 t60 -147.65 125.07 11.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 74.420000000000002 110.868 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 63.24 38.41 10.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.243 -0.435 . . . . 70.540000000000006 110.863 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.2 t 62.6 15.41 7.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 62.329999999999998 110.898 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -112.59 177.58 4.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.115 -0.493 . . . . 75.140000000000001 110.884 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.6 mt -132.46 129.7 39.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 74.129999999999995 110.927 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.498 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.2 m-85 -124.53 175.4 7.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 75.5 110.897 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 30.0 mtp180 -133.47 139.22 46.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 74.150000000000006 110.852 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -64.75 111.14 2.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 73.310000000000002 110.93 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -86.96 -57.91 2.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 75.510000000000005 110.909 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.75 167.89 27.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.040000000000006 110.881 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -127.38 131.61 50.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.224 -0.444 . . . . 74.540000000000006 111.093 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -117.71 100.05 7.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 62.049999999999997 111.129 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.33 -96.44 0.2 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.705 -0.76 . . . . 72.310000000000002 112.431 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -113.55 2.34 15.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.91 0.386 . . . . 74.239999999999995 110.896 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -105.07 157.6 17.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 75.5 110.847 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.5 t -136.66 116.67 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 65.439999999999998 111.137 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -79.09 146.71 33.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 73.510000000000005 110.956 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.431 ' CG ' HD22 ' A' ' 23' ' ' LEU . 69.1 m95 -136.51 167.38 21.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 71.310000000000002 110.981 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.6 ptt? -152.52 132.64 13.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.427 . . . . 71.040000000000006 110.86 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -45.43 113.93 0.67 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.215 -0.448 . . . . 73.439999999999998 110.893 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 18.0 ptt180 -54.89 -28.74 52.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 73.400000000000006 110.87 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.47 48.19 1.54 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 61.119999999999997 110.866 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -84.76 -37.04 21.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 74.129999999999995 110.95 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.17 -12.9 29.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 72.349999999999994 111.078 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.94 -40.99 7.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 74.209999999999994 110.855 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 51' ' ' GLY . 90.3 mt -114.76 23.99 12.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 71.230000000000004 110.886 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.96 53.14 0.86 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.707 -0.759 . . . . 73.510000000000005 112.5 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.61 118.45 25.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.86 0.362 . . . . 75.439999999999998 110.897 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.8 mmt85 -105.58 50.23 0.78 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 73.329999999999998 110.815 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.3 t -87.33 117.26 25.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 74.120000000000005 110.806 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -105.15 161.55 14.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.141 -0.481 . . . . 74.109999999999999 110.902 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.484 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -148.08 163.01 38.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 64.150000000000006 111.059 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 70.2 mt -127.32 127.79 69.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 75.030000000000001 111.117 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.429 HG23 ' NE1' ' A' ' 42' ' ' TRP . 42.1 p -110.94 144.31 40.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 74.230000000000004 111.191 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -128.46 90.29 3.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.415 . . . . 74.030000000000001 110.995 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.95 -86.73 0.97 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.732 -0.747 . . . . 61.310000000000002 112.456 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.445 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.5 OUTLIER -124.68 7.87 8.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.771 0.32 . . . . 73.120000000000005 110.854 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.44 ' HG3' ' N ' ' A' ' 63' ' ' ILE . 10.3 ptt180 -105.82 180.0 4.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 72.340000000000003 110.831 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.562 HD11 ' CD2' ' A' ' 25' ' ' HIS . 17.5 tt -151.0 153.8 9.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 74.430000000000007 111.166 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.484 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 30.3 ttp -144.3 147.1 33.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 63.32 110.924 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 t -116.88 145.69 22.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 71.310000000000002 111.125 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 2.4 mtt -112.38 -62.31 1.59 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 72.299999999999997 110.871 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 -96.32 177.48 5.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.277 -0.42 . . . . 74.230000000000004 110.836 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.7 m -100.64 174.02 6.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 65.420000000000002 110.819 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.411 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 74.4 m-70 -107.88 127.69 53.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 73.209999999999994 110.85 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 8.2 t -82.53 14.74 2.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 73.420000000000002 110.897 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 27.8 p80 -145.12 153.12 41.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 75.040000000000006 110.842 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -86.8 152.49 54.01 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.621 0.724 . . . . 74.010000000000005 110.89 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 152.85 69.54 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.676 2.251 . . . . 60.130000000000003 112.377 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.55 90.95 3.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 62.43 110.878 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 18.8 mt -58.69 -31.13 67.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 72.450000000000003 110.92 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -68.58 -31.97 71.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 63.210000000000001 111.153 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -88.54 -37.5 7.48 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.675 -0.774 . . . . 62.520000000000003 112.534 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.422 ' CD1' HG13 ' A' ' 24' ' ' VAL . 10.2 tp -72.6 -40.09 66.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.722 0.296 . . . . 72.430000000000007 110.892 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.546 ' N ' HH21 ' A' ' 82' ' ' ARG . 30.8 mm-40 -64.22 -30.35 71.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 63.219999999999999 110.867 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.12 -59.53 4.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 54.409999999999997 111.095 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.4 mt -39.47 -43.46 1.25 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.97 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.546 HH21 ' N ' ' A' ' 79' ' ' GLU . 55.6 mtm180 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.101 -0.5 . . . . 74.540000000000006 110.878 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.41 HD21 ' CZ ' ' A' ' 13' ' ' PHE . 25.9 tp . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.816 0.341 . . . . 63.549999999999997 110.933 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -102.32 150.0 23.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 73.340000000000003 110.908 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.479 ' CE2' HD12 ' A' ' 23' ' ' LEU . 37.1 m-85 -139.42 172.05 13.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.114 -0.494 . . . . 74.420000000000002 110.914 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.9 mt -144.45 151.78 39.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 73.040000000000006 110.94 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 79.1 mtm-85 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.269 -0.423 . . . . 74.129999999999995 110.866 179.967 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.924 0.392 . . . . 74.400000000000006 110.842 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -107.45 158.79 16.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 71.519999999999996 110.875 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.479 HD12 ' CE2' ' A' ' 13' ' ' PHE . 8.9 tp -125.1 114.64 19.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.16 -0.473 . . . . 73.349999999999994 110.91 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 53.5 t -87.96 119.46 35.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 74.150000000000006 111.124 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.556 ' CD2' HD12 ' A' ' 63' ' ' ILE . 25.2 t60 -156.45 126.17 6.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.247 -0.433 . . . . 71.439999999999998 110.937 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 61.53 41.07 12.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.234 -0.439 . . . . 75.030000000000001 110.87 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.3 m 58.37 32.44 22.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.091 -0.504 . . . . 74.310000000000002 110.858 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.43 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 16.7 m-85 -131.41 -175.48 3.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 65.010000000000005 110.938 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.442 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 29.3 mt -140.63 133.23 28.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 74.299999999999997 110.886 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.51 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.1 m-85 -127.89 162.64 26.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 75.239999999999995 110.915 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.5 mtp180 -120.74 136.16 54.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 75.230000000000004 110.897 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.5 tttp -58.66 112.07 1.49 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 75.340000000000003 110.97 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.44 ' OE1' ' NH2' ' A' ' 55' ' ' ARG . 1.6 tm-20 -82.87 -51.22 7.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.431 . . . . 73.099999999999994 110.937 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.548 ' CD ' ' CD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -158.52 179.12 9.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 74.340000000000003 110.898 179.935 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -130.78 135.31 47.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 63.0 111.098 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -118.76 -172.58 2.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 51.009999999999998 111.111 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.25 92.12 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 74.239999999999995 112.478 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 66.71 43.24 2.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.917 0.389 . . . . 71.109999999999999 110.914 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -154.26 159.18 41.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 71.340000000000003 110.882 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.459 HG11 ' CE2' ' A' ' 42' ' ' TRP . 14.3 t -135.78 121.01 28.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 73.519999999999996 111.096 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.548 ' CD1' ' CD ' ' A' ' 34' ' ' LYS . 8.9 m-85 -85.39 149.12 25.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 75.230000000000004 110.914 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.459 ' CE2' HG11 ' A' ' 40' ' ' VAL . 70.0 m95 -143.0 149.76 38.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 74.310000000000002 110.914 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -135.36 130.83 35.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 73.109999999999999 110.913 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.432 ' O ' ' N ' ' A' ' 46' ' ' ASP . 2.2 t -46.59 107.56 0.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 73.129999999999995 110.861 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.442 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.7 ptt-85 -40.23 -27.28 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 72.219999999999999 110.843 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 44' ' ' CYS . 0.3 OUTLIER -88.8 40.52 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 71.239999999999995 110.845 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -86.43 -37.46 18.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 73.519999999999996 110.909 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.62 -15.08 23.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 74.510000000000005 111.079 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.8 tpp180 -92.41 -61.93 1.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 73.230000000000004 110.89 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.1 mt -103.54 29.17 5.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 73.310000000000002 110.954 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.59 47.31 4.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.757 -0.735 . . . . 74.140000000000001 112.501 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.2 t -105.5 72.86 0.99 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.893 0.378 . . . . 65.329999999999998 110.931 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.462 ' HD2' ' N ' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -55.88 -13.88 2.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.12 -0.491 . . . . 75.400000000000006 110.828 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.451 ' N ' ' HD3' ' A' ' 53' ' ' ARG . 3.4 t -35.55 122.72 0.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 54.450000000000003 110.89 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.44 ' NH2' ' OE1' ' A' ' 33' ' ' GLU . 37.5 mtp180 -118.71 177.06 4.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 72.349999999999994 110.876 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -161.62 151.4 16.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 53.520000000000003 111.091 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.433 ' O ' ' N ' ' A' ' 64' ' ' MET . 61.7 mt -121.84 133.63 67.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 73.099999999999994 111.098 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.7 p -116.01 144.39 44.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 71.430000000000007 111.146 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -126.79 88.94 2.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 74.230000000000004 110.928 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 81.55 -86.92 1.39 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.711 -0.757 . . . . 72.329999999999998 112.417 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.403 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -126.03 8.12 7.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.752 0.31 . . . . 74.349999999999994 110.845 -179.885 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.409 ' HG3' ' N ' ' A' ' 63' ' ' ILE . 8.2 ptm180 -106.42 179.82 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 71.109999999999999 110.867 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.556 HD12 ' CD2' ' A' ' 25' ' ' HIS . 20.4 tt -150.95 151.73 12.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 71.140000000000001 111.162 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.433 ' N ' ' O ' ' A' ' 57' ' ' ILE . 3.9 mpp? -140.91 140.11 34.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 71.519999999999996 110.904 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.5 t -109.8 140.25 29.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 75.349999999999994 111.085 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 6.8 mmt -104.0 -53.78 2.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.153 -0.476 . . . . 73.420000000000002 110.864 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.3 mtp85 -115.05 167.67 10.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 74.409999999999997 110.93 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.0 m -86.54 -175.76 5.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 74.099999999999994 110.848 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 63.6 m-70 -118.85 137.3 53.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.17 -0.468 . . . . 75.420000000000002 110.841 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 16.6 t -91.29 9.99 29.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 51.200000000000003 110.786 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 33.0 p80 -138.23 157.3 46.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 75.329999999999998 110.916 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -89.96 156.49 46.81 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.599 0.714 . . . . 74.230000000000004 110.898 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.43 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 54.0 Cg_endo -69.7 140.19 42.31 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.727 2.285 . . . . 62.200000000000003 112.335 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -102.53 80.95 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 72.209999999999994 110.903 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 57.2 mt -53.78 -16.47 1.74 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 71.120000000000005 110.963 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.22 -57.65 2.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.441 . . . . 70.540000000000006 111.073 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.79 -33.67 83.89 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.726 -0.749 . . . . 74.129999999999995 112.453 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.9 tp -70.53 -49.52 47.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.784 0.326 . . . . 75.420000000000002 110.936 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -62.24 -31.75 72.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 63.109999999999999 110.844 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.61 -54.57 22.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 73.099999999999994 111.063 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 15.8 mt -56.19 -32.39 64.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 61.109999999999999 110.928 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 6.5 mtp-105 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 75.219999999999999 110.917 179.91 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.555 HD21 ' CZ ' ' A' ' 13' ' ' PHE . 22.6 tp . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.733 0.301 . . . . 74.329999999999998 110.925 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.468 ' C ' ' CD1' ' A' ' 13' ' ' PHE . 4.8 tp10 -118.57 150.03 40.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 72.140000000000001 110.881 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.555 ' CZ ' HD21 ' A' ' 11' ' ' LEU . 1.9 m-85 -139.97 168.05 20.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 74.030000000000001 110.865 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.402 ' CD2' ' HA ' ' A' ' 82' ' ' ARG . 8.6 mt -135.26 117.24 15.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.17 -0.468 . . . . 75.099999999999994 110.896 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.3 ttt-85 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 73.340000000000003 110.842 179.974 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 tpp85 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.856 0.36 . . . . 74.340000000000003 110.848 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -116.01 160.59 20.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 72.150000000000006 110.833 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.42 ' CD1' HD21 ' A' ' 11' ' ' LEU . 8.1 tp -122.63 113.89 19.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.065 -0.516 . . . . 73.219999999999999 110.908 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 88.8 t -88.6 117.57 32.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 73.530000000000001 111.115 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.464 ' CE1' HG22 ' A' ' 63' ' ' ILE . 8.4 t60 -153.22 124.88 7.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 70.299999999999997 110.889 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 62.17 45.3 7.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.278 -0.419 . . . . 64.010000000000005 110.909 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 53.61 21.95 2.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.139 -0.482 . . . . 75.230000000000004 110.831 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -119.57 -179.95 4.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 63.43 110.902 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.421 HD11 ' CZ ' ' A' ' 45' ' ' ARG . 43.6 mt -129.91 136.99 50.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 74.549999999999997 110.924 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.519 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -133.6 167.06 21.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 73.420000000000002 110.936 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.8 mtp180 -130.34 138.27 50.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 73.209999999999994 110.874 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 31.4 tttm -57.12 119.92 7.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.219 -0.446 . . . . 74.129999999999995 110.897 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -95.83 -55.09 3.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.282 -0.417 . . . . 74.140000000000001 110.876 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 45.5 pttt -151.13 178.68 8.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.107 -0.497 . . . . 75.329999999999998 110.864 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.02 121.21 15.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 62.229999999999997 111.19 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.4 56.74 3.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 63.140000000000001 111.094 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.31 -65.75 3.77 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.739 -0.743 . . . . 60.32 112.492 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -117.37 -20.87 8.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.883 0.373 . . . . 72.040000000000006 110.87 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.4 mtmm -93.4 161.32 14.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 75.040000000000006 110.937 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 t -137.03 116.12 15.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.29 -0.414 . . . . 74.209999999999994 111.12 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -81.67 149.78 28.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 71.409999999999997 110.929 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.511 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 62.9 m95 -138.75 158.59 43.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.102 -0.499 . . . . 64.420000000000002 110.857 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 7.0 ptt? -142.24 137.97 31.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 73.310000000000002 110.867 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.41 ' C ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -46.42 108.39 0.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 75.319999999999993 110.906 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.421 ' CZ ' HD11 ' A' ' 29' ' ' LEU . 19.6 ptt180 -44.4 -22.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 71.450000000000003 110.848 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.41 ' N ' ' C ' ' A' ' 44' ' ' CYS . 0.5 OUTLIER -84.09 35.79 0.54 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.438 . . . . 70.420000000000002 110.904 179.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.4 ' HG3' ' N ' ' A' ' 48' ' ' ALA . 0.5 OUTLIER -48.27 -65.28 0.59 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.182 -0.463 . . . . 71.430000000000007 110.941 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.4 ' N ' ' HG3' ' A' ' 47' ' ' GLN . . . -92.56 -33.07 14.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.226 -0.443 . . . . 73.530000000000001 111.096 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.75 -46.2 70.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.235 -0.439 . . . . 73.519999999999996 110.928 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.453 HD13 ' CG ' ' A' ' 71' ' ' HIS . 58.7 mt -123.69 25.93 7.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 73.209999999999994 110.872 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 39.36 43.94 2.16 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.694 -0.765 . . . . 71.209999999999994 112.529 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.4 t -96.89 148.24 23.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.35 . . . . 74.319999999999993 110.854 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.79 33.91 3.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.182 -0.463 . . . . 73.239999999999995 110.902 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.5 t -84.9 118.18 24.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 73.430000000000007 110.854 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -112.29 146.55 38.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 74.140000000000001 110.837 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.409 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -137.41 157.33 46.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 71.530000000000001 111.139 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 84.7 mt -123.18 126.16 73.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 73.230000000000004 111.074 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.445 HG23 ' NE1' ' A' ' 42' ' ' TRP . 43.0 p -102.02 152.15 21.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 71.430000000000007 111.131 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.8 tm0? -154.61 108.03 2.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 73.450000000000003 110.87 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.02 -97.35 0.92 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.774 -0.727 . . . . 72.140000000000001 112.571 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -128.77 11.25 6.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.812 0.339 . . . . 74.549999999999997 110.81 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -117.63 176.4 5.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 75.329999999999998 110.863 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.464 HG22 ' CE1' ' A' ' 25' ' ' HIS . 21.2 tt -143.92 159.43 16.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 75.230000000000004 111.147 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.409 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 5.6 ttp -135.72 148.97 49.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 75.120000000000005 110.914 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.6 t -120.13 142.61 35.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 72.329999999999998 111.139 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.4 mtp -117.73 -63.48 1.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 73.530000000000001 110.888 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -89.61 171.24 9.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 74.319999999999993 110.809 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -103.44 174.04 6.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.102 -0.499 . . . . 73.120000000000005 110.841 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.449 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 62.2 m-70 -110.09 132.66 53.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.49 . . . . 72.120000000000005 110.837 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 2.1 t -90.26 13.87 14.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 74.530000000000001 110.896 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.453 ' CG ' HD13 ' A' ' 50' ' ' LEU . 27.1 p80 -140.33 156.9 46.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 70.030000000000001 110.816 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -92.49 155.3 42.37 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 121.565 0.697 . . . . 71.439999999999998 110.883 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 162.23 42.87 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.659 2.239 . . . . 74.25 112.327 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.36 79.93 1.73 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 74.430000000000007 110.829 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.0 mt -46.35 -23.24 0.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 71.219999999999999 110.955 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.59 -40.93 72.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 54.219999999999999 111.111 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -80.44 -40.5 12.94 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.754 -0.736 . . . . 64.310000000000002 112.48 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.1 tp -65.77 -39.63 91.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.78 0.324 . . . . 72.310000000000002 110.909 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -63.64 -31.95 73.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 74.510000000000005 110.9 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.67 -31.57 72.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.491 . . . . 75.340000000000003 111.097 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.8 mt -79.35 -28.26 42.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 73.219999999999999 110.934 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.402 ' HA ' ' CD2' ' A' ' 14' ' ' LEU . 69.5 mtp180 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 74.450000000000003 110.84 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.47 ' H ' ' CE1' ' A' ' 61' ' ' HIS . 20.7 tp . . . . . 0 CA--C 1.526 0.037 0 CA-C-O 120.833 0.349 . . . . 74.129999999999995 110.877 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -107.31 151.67 25.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 72.150000000000006 110.849 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.539 ' CD2' HD11 ' A' ' 23' ' ' LEU . 72.1 m-85 -137.22 172.96 12.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.121 -0.49 . . . . 75.450000000000003 110.83 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.407 ' O ' ' CD ' ' A' ' 21' ' ' ARG . 16.6 mt -147.81 174.1 12.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.088 -0.506 . . . . 75.450000000000003 110.937 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 75.349999999999994 110.816 179.94 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.407 ' CD ' ' O ' ' A' ' 14' ' ' LEU . 12.1 tpt180 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.786 0.327 . . . . 62.409999999999997 110.916 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -107.42 158.67 16.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 64.099999999999994 110.936 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.539 HD11 ' CD2' ' A' ' 13' ' ' PHE . 13.1 tp -124.11 115.96 22.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.466 . . . . 74.209999999999994 110.935 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.3 t -90.35 115.51 29.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 64.010000000000005 111.086 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.564 ' CD2' HD12 ' A' ' 63' ' ' ILE . 29.7 t60 -153.49 132.77 12.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 74.310000000000002 110.809 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 60.02 33.16 21.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 75.439999999999998 110.967 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.8 m 65.43 29.23 11.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.119 -0.491 . . . . 54.32 110.909 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.452 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 14.8 m-85 -130.74 -174.68 3.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.109 -0.496 . . . . 64.439999999999998 110.848 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.422 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 9.8 mt -138.86 132.7 30.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.108 -0.496 . . . . 74.140000000000001 110.967 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.522 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -125.96 166.92 16.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.19 -0.459 . . . . 75.099999999999994 110.973 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -126.29 126.42 43.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.132 -0.486 . . . . 75.5 110.843 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -45.18 108.58 0.13 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.151 -0.477 . . . . 64.340000000000003 110.878 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -82.89 -53.41 5.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 73.120000000000005 110.927 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.442 ' HD2' ' CG ' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -159.16 178.8 9.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.083 -0.508 . . . . 74.310000000000002 110.923 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -130.52 128.61 41.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.446 . . . . 63.539999999999999 111.068 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.41 19.91 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 75.530000000000001 111.07 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 90.86 -49.65 3.1 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.731 -0.747 . . . . 74.230000000000004 112.472 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -111.32 -18.83 12.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.922 0.391 . . . . 71.209999999999994 110.866 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.451 ' HB3' ' CG2' ' A' ' 57' ' ' ILE . 9.9 mtmm -123.02 170.64 9.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.236 -0.438 . . . . 73.540000000000006 110.938 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.441 ' O ' ' CD1' ' A' ' 42' ' ' TRP . 4.7 t -133.53 119.13 33.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.236 -0.438 . . . . 71.319999999999993 111.114 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.442 ' CG ' ' HD2' ' A' ' 34' ' ' LYS . 2.9 m-85 -75.79 150.3 37.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.113 -0.494 . . . . 74.420000000000002 110.922 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.441 ' CD1' ' O ' ' A' ' 40' ' ' VAL . 75.3 m95 -142.92 121.96 12.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.106 -0.497 . . . . 64.299999999999997 110.892 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -106.26 136.06 46.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.239 -0.437 . . . . 72.230000000000004 110.877 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.6 t -50.4 113.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 74.140000000000001 110.924 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 20.7 ptt-85 -44.66 -35.16 2.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 74.230000000000004 110.927 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.69 44.31 0.62 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 74.420000000000002 110.902 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -88.77 -26.18 21.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 75.439999999999998 110.914 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.77 -30.72 12.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 61.420000000000002 111.106 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.434 ' CB ' ' CZ ' ' A' ' 49' ' ' ARG . 4.5 ttp-105 -89.04 -62.34 1.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 73.420000000000002 110.855 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.417 HD11 ' CD2' ' A' ' 71' ' ' HIS . 88.5 mt -90.37 20.31 4.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 72.430000000000007 110.867 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 36.72 36.88 0.19 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.721 -0.752 . . . . 72.099999999999994 112.512 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.7 t -89.33 120.67 30.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.791 0.329 . . . . 74.439999999999998 110.877 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 40.8 mmm-85 -98.75 13.75 31.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.456 . . . . 74.549999999999997 110.857 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.507 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 23.2 t -61.26 108.21 0.88 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 74.540000000000006 110.94 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.43 ' CB ' ' CZ ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -111.08 164.33 12.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 71.340000000000003 110.868 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.473 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -157.23 159.93 38.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.420000000000002 111.13 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.451 ' CG2' ' HB3' ' A' ' 39' ' ' LYS . 74.6 mt -123.98 128.49 74.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.234 -0.439 . . . . 74.329999999999998 111.16 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.43 HG21 ' NE1' ' A' ' 42' ' ' TRP . 30.0 p -101.29 144.21 30.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 55.020000000000003 111.14 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.56 111.02 6.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 73.430000000000007 110.88 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 68.73 -94.77 0.36 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.717 -0.754 . . . . 74.040000000000006 112.505 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.47 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -128.68 7.28 5.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.832 0.348 . . . . 75.129999999999995 110.894 -179.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -112.41 178.82 4.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 73.150000000000006 110.872 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.564 HD12 ' CD2' ' A' ' 25' ' ' HIS . 20.2 tt -145.74 157.87 12.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 75.219999999999999 111.172 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.473 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 2.7 ttp -135.31 140.66 45.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 74.420000000000002 110.804 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.422 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 61.1 t -106.37 143.22 17.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 74.409999999999997 111.162 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.0 mtp -117.96 -55.21 2.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 74.439999999999998 110.897 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -110.75 144.91 38.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 74.310000000000002 110.828 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.3 p -75.39 168.71 19.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 74.439999999999998 110.783 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.507 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 72.6 m-70 -104.5 132.75 50.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.5 . . . . 74.340000000000003 110.833 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.6 t -86.21 11.95 10.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 75.420000000000002 110.853 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.417 ' CD2' HD11 ' A' ' 50' ' ' LEU . 25.9 p80 -140.2 154.96 47.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 74.450000000000003 110.858 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -89.52 152.36 47.17 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.67 0.747 . . . . 72.540000000000006 110.878 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.452 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.77 159.58 52.86 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.665 2.243 . . . . 71.219999999999999 112.365 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.48 85.68 2.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 44.219999999999999 110.892 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.2 mt -52.34 -18.17 1.48 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 65.420000000000002 110.918 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.6 -52.28 13.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 73.510000000000005 111.099 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -70.98 -34.96 64.94 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.666 -0.778 . . . . 51.130000000000003 112.571 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.1 tp -68.55 -42.04 78.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.802 0.334 . . . . 73.329999999999998 110.937 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.57 -40.81 97.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 64.319999999999993 110.891 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.95 -28.45 57.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.239999999999995 111.102 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.2 mt -81.59 -29.65 33.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.400000000000006 110.943 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 41.4 mtp180 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 75.450000000000003 110.901 179.89 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.514 HD22 ' CE1' ' A' ' 13' ' ' PHE . 23.7 tp . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.817 0.342 . . . . 73.400000000000006 110.909 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -91.66 136.71 32.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 73.230000000000004 110.857 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.514 ' CE1' HD22 ' A' ' 11' ' ' LEU . 68.3 m-85 -136.82 169.65 17.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 73.430000000000007 110.898 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.406 HD21 ' CG ' ' A' ' 82' ' ' ARG . 12.8 mt -143.92 120.99 11.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 73.310000000000002 110.931 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 62.409999999999997 110.881 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 ttp180 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.798 0.333 . . . . 74.030000000000001 110.852 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -129.25 166.04 20.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 74.230000000000004 110.88 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.49 HD23 ' CG ' ' A' ' 42' ' ' TRP . 5.0 tp -133.18 113.42 12.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.171 -0.468 . . . . 71.299999999999997 110.91 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.4 t -88.06 119.53 35.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 72.030000000000001 111.164 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.526 ' CD2' ' CD1' ' A' ' 63' ' ' ILE . 4.7 t60 -155.85 132.38 10.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 75.319999999999993 110.821 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 58.19 36.72 26.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.282 -0.417 . . . . 64.5 110.851 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m 62.23 26.07 15.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 72.540000000000006 110.822 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -126.29 -178.63 4.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 74.25 110.923 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.528 ' CD1' ' CZ ' ' A' ' 45' ' ' ARG . 67.8 mt -132.75 136.19 46.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.477 . . . . 72.420000000000002 110.926 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.511 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -130.46 159.46 36.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 71.109999999999999 110.878 -179.944 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.449 ' NE ' ' HA ' ' A' ' 45' ' ' ARG . 3.0 mtt180 -113.96 136.81 52.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 75.439999999999998 110.881 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.4 tttt -61.28 108.67 0.96 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 64.519999999999996 110.892 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -81.01 -60.06 2.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.278 -0.419 . . . . 74.319999999999993 110.89 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 26.8 pttt -153.0 177.71 10.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 75.450000000000003 110.888 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -138.49 117.57 12.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.441 . . . . 64.120000000000005 111.134 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.8 91.75 4.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 75.420000000000002 111.142 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.25 -85.84 0.1 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.73 -0.748 . . . . 74.230000000000004 112.539 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -117.26 0.17 12.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.91 0.386 . . . . 74.129999999999995 110.879 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.416 ' CE ' HG23 ' A' ' 57' ' ' ILE . 55.8 mtpt -102.94 156.77 17.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 75.219999999999999 110.893 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.5 t -138.25 117.6 14.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.267 -0.424 . . . . 60.030000000000001 111.126 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.423 ' CE2' HD11 ' A' ' 57' ' ' ILE . 9.1 m-85 -82.07 146.64 29.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 74.150000000000006 110.952 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.49 ' CG ' HD23 ' A' ' 23' ' ' LEU . 71.8 m95 -137.3 159.64 41.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.13 -0.486 . . . . 75.219999999999999 110.904 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.1 ptt? -143.64 126.13 15.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 74.340000000000003 110.908 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -38.16 114.11 0.33 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.271 -0.422 . . . . 62.32 110.871 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.528 ' CZ ' ' CD1' ' A' ' 29' ' ' LEU . 20.2 ptt180 -52.64 -22.57 5.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 73.439999999999998 110.864 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.56 43.32 1.02 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 72.420000000000002 110.867 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -85.86 -35.51 20.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.456 . . . . 72.329999999999998 110.885 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.6 -9.3 27.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 71.409999999999997 111.103 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 ttm-85 -98.29 -54.7 2.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 74.239999999999995 110.864 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.3 mt -110.05 26.46 10.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 74.430000000000007 110.886 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.14 47.38 4.33 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.757 -0.735 . . . . 73.040000000000006 112.494 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.1 t -94.94 147.08 23.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.747 0.308 . . . . 72.140000000000001 110.918 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.406 ' CB ' ' NH1' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -132.07 26.65 4.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 74.439999999999998 110.857 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.0 t -78.07 109.53 12.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 73.510000000000005 110.828 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.406 ' NH1' ' CB ' ' A' ' 53' ' ' ARG . 9.7 mpt_? -103.75 158.29 16.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.329999999999998 110.915 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -149.13 161.39 42.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 75.439999999999998 111.064 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 41' ' ' TYR . 40.6 mt -127.19 121.57 57.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 55.009999999999998 111.12 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.5 p -102.58 143.71 31.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.49 . . . . 73.129999999999995 111.127 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -129.25 87.05 2.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.243 -0.435 . . . . 70.209999999999994 110.944 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.81 -82.26 1.09 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.742 -0.742 . . . . 73.349999999999994 112.509 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -127.75 9.59 6.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.709 0.29 . . . . 65.409999999999997 110.794 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -111.68 170.49 8.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.169 -0.468 . . . . 73.510000000000005 110.896 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.526 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 5.7 tt -148.13 145.46 18.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 72.209999999999994 111.139 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -132.7 133.31 43.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 74.439999999999998 110.897 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.2 t -104.45 130.0 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.416 . . . . 73.230000000000004 111.082 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.4 mmt -102.46 -62.82 1.22 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 71.230000000000004 110.858 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.21 172.93 8.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.272 -0.422 . . . . 72.409999999999997 110.842 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -106.24 168.07 9.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 63.119999999999997 110.919 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.425 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 48.0 m-70 -105.19 130.98 53.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 72.319999999999993 110.899 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.9 t -88.51 11.93 15.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.208 -0.451 . . . . 53.240000000000002 110.877 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -137.48 161.0 37.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 73.439999999999998 110.827 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -97.22 151.95 37.99 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.55 0.691 . . . . 75.409999999999997 110.963 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 154.08 68.29 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.699 2.266 . . . . 74.150000000000006 112.369 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -131.36 79.67 1.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.182 -0.463 . . . . 72.010000000000005 110.845 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.6 mt -44.18 -23.43 0.1 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 74.409999999999997 110.868 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.99 -47.82 67.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.451 . . . . 61.140000000000001 111.138 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.52 -35.58 59.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.704 -0.76 . . . . 73.040000000000006 112.548 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -71.01 -35.35 72.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.727 0.299 . . . . 72.340000000000003 110.906 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -74.6 -25.05 59.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 75.530000000000001 110.879 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.93 -31.09 69.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 74.439999999999998 111.087 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.0 mt -86.39 -32.05 21.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.266 -0.424 . . . . 75.219999999999999 110.92 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.406 ' CG ' HD21 ' A' ' 14' ' ' LEU . 3.6 mtp-105 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 75.439999999999998 110.813 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 13' ' ' PHE . 14.0 tp . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.755 0.312 . . . . 75.430000000000007 110.95 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -90.5 139.94 30.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 61.219999999999999 110.883 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.518 ' CD1' HD11 ' A' ' 23' ' ' LEU . 68.7 m-85 -138.88 169.53 17.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.13 -0.487 . . . . 71.420000000000002 110.817 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.402 HD11 ' CG2' ' A' ' 24' ' ' VAL . 14.8 mt -142.3 162.01 36.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 75.099999999999994 110.873 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 45.4 mtp180 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 73.439999999999998 110.911 179.938 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.7 ttm180 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.897 0.38 . . . . 72.519999999999996 110.849 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -116.88 157.8 25.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 75.120000000000005 110.841 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.518 HD11 ' CD1' ' A' ' 13' ' ' PHE . 13.6 tp -120.84 117.08 26.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 75.239999999999995 110.853 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.402 ' CG2' HD11 ' A' ' 14' ' ' LEU . 93.7 t -92.31 117.33 35.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 64.299999999999997 111.132 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.752 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 5.7 t60 -153.52 127.76 9.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.462 . . . . 74.549999999999997 110.828 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 61.23 41.63 13.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 74.200000000000003 110.884 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.4 m 54.84 35.56 24.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 64.340000000000003 110.848 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.465 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 19.1 m-85 -133.03 -176.76 4.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 62.409999999999997 110.91 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.454 ' CD1' ' CZ ' ' A' ' 45' ' ' ARG . 56.5 mt -133.66 132.66 40.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 75.219999999999999 110.951 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.517 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -128.43 169.06 14.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 74.450000000000003 110.921 -179.925 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.454 ' HB3' ' CZ ' ' A' ' 31' ' ' ARG . 2.1 mtp-105 -129.69 142.99 50.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 73.349999999999994 110.889 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -64.13 109.02 1.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 75.109999999999999 110.903 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -83.06 -55.08 4.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 73.450000000000003 110.853 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.0 pttt -153.36 -176.13 5.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 62.030000000000001 110.927 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.75 128.05 22.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 74.099999999999994 111.129 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' A' ' 38' ' ' GLU . . . -114.07 -177.12 3.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 74.510000000000005 111.053 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -42.7 95.31 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.678 -0.772 . . . . 64.019999999999996 112.449 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 36' ' ' ALA . 7.0 mp0 55.6 42.65 29.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.94 0.4 . . . . 74.099999999999994 110.873 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.443 ' HD2' ' CG2' ' A' ' 57' ' ' ILE . 39.6 mtmt -150.12 160.68 43.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.218 -0.446 . . . . 71.120000000000005 110.833 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.5 t -138.94 121.0 17.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 73.310000000000002 111.133 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -85.3 139.42 31.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 75.099999999999994 110.903 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.1 m95 -129.55 157.04 43.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.131 -0.486 . . . . 74.329999999999998 110.924 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 20.3 ptt? -144.07 136.25 26.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 72.409999999999997 110.819 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.4 t -46.39 114.95 0.9 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 72.140000000000001 110.832 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.454 ' CZ ' ' CD1' ' A' ' 29' ' ' LEU . 19.0 ptt180 -55.18 -21.43 13.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.118 -0.492 . . . . 73.420000000000002 110.883 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.33 36.6 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 74.019999999999996 110.892 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -80.54 -36.45 33.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 73.530000000000001 110.927 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.43 -15.33 25.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.185 -0.461 . . . . 64.400000000000006 111.046 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.5 ttm180 -98.79 -62.12 1.28 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 73.010000000000005 110.806 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.424 ' O ' ' C ' ' A' ' 51' ' ' GLY . 95.4 mt -97.28 26.84 4.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 72.299999999999997 110.939 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.02 47.72 1.03 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.753 -0.736 . . . . 70.230000000000004 112.538 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 7.6 t -95.65 148.96 21.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.771 0.32 . . . . 74.120000000000005 110.895 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 27.7 mmm180 -124.83 8.25 8.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 75.439999999999998 110.937 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.462 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 22.8 t -58.36 147.13 32.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 50.409999999999997 110.845 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 46.9 mtt180 -146.98 164.2 33.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 73.010000000000005 110.862 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.484 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -152.43 153.81 34.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 73.019999999999996 111.149 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.443 ' CG2' ' HD2' ' A' ' 39' ' ' LYS . 85.8 mt -119.25 126.22 75.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.23 -0.441 . . . . 73.230000000000004 111.058 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 49.7 p -103.05 144.69 30.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 74.450000000000003 111.144 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -133.81 87.11 2.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 73.349999999999994 110.925 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.9 -86.62 1.55 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 72.439999999999998 112.472 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.409 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.5 OUTLIER -128.11 -5.59 5.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.75 0.31 . . . . 72.120000000000005 110.832 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.1 mtm105 -96.4 -178.32 4.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 74.120000000000005 110.885 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.512 HD11 ' CD2' ' A' ' 25' ' ' HIS . 8.5 tt -150.63 156.44 6.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 74.430000000000007 111.156 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.484 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 1.6 ttp -143.26 144.78 32.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 72.5 110.892 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.752 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 86.3 t -102.08 148.64 7.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.227 -0.442 . . . . 74.030000000000001 111.14 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 19.1 mtm -119.23 -62.15 1.55 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 73.150000000000006 110.899 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.9 mtt85 -103.11 164.31 11.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 73.340000000000003 110.921 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.2 m -90.86 175.34 7.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 75.25 110.903 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.462 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 65.1 m-70 -112.88 134.6 54.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 74.310000000000002 110.895 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.6 m -92.0 13.42 18.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.465 . . . . 72.340000000000003 110.956 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 31.0 p80 -139.67 166.3 24.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.133 -0.485 . . . . 75.129999999999995 110.876 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -95.66 153.72 39.34 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.635 0.731 . . . . 73.030000000000001 110.963 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.465 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.74 152.7 69.48 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.73 2.286 . . . . 71.25 112.312 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -114.37 75.67 0.94 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 74.450000000000003 110.912 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.6 mt -49.56 -19.76 0.64 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.242 -0.435 . . . . 71.310000000000002 110.927 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.02 -50.01 6.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 74.409999999999997 111.073 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.76 -34.01 88.78 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.744 -0.741 . . . . 64.430000000000007 112.472 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -73.65 -44.49 56.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.823 0.344 . . . . 74.409999999999997 111.0 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.64 -26.76 68.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 71.530000000000001 110.875 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.82 -55.57 14.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 72.5 111.129 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.5 mt -46.51 -49.32 18.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 74.209999999999994 110.946 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.1 mtt-85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 74.319999999999993 110.881 179.913 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.528 HD23 ' CE2' ' A' ' 13' ' ' PHE . 18.0 tp . . . . . 0 C--O 1.23 0.06 0 CA-C-O 120.837 0.351 . . . . 71.25 110.875 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -110.89 140.44 45.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.158 -0.474 . . . . 72.349999999999994 110.899 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.528 ' CE2' HD23 ' A' ' 11' ' ' LEU . 8.6 m-85 -137.33 172.96 12.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.474 . . . . 74.25 110.89 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.408 ' CD2' ' HG3' ' A' ' 82' ' ' ARG . 3.7 mt -148.04 160.23 43.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.19 -0.459 . . . . 75.150000000000006 110.906 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 75.040000000000006 110.848 179.991 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.784 0.326 . . . . 73.540000000000006 110.892 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -123.95 160.89 26.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 74.209999999999994 110.928 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.9 tp -122.56 118.69 28.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.205 -0.452 . . . . 74.420000000000002 110.918 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.2 t -94.79 108.22 20.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 73.310000000000002 111.166 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.469 ' CG ' HD11 ' A' ' 63' ' ' ILE . 50.1 t60 -145.12 134.14 22.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 73.299999999999997 110.86 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 59.54 33.18 22.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 71.140000000000001 110.94 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.1 m 65.3 25.39 12.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 75.340000000000003 110.854 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.539 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 15.4 m-85 -127.84 179.18 5.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 72.239999999999995 110.875 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 11.2 mt -128.37 133.14 48.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.144 -0.48 . . . . 73.239999999999995 110.931 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.505 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.1 m-85 -124.57 164.19 20.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.244 -0.435 . . . . 75.040000000000006 110.906 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.2 mtp180 -123.23 134.34 54.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 74.209999999999994 110.85 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 34.4 tttm -59.93 110.02 1.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 72.439999999999998 110.84 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -85.0 -54.08 4.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 73.319999999999993 110.916 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.412 ' CG ' ' HB2' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -146.55 171.26 15.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 75.030000000000001 110.881 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -133.39 115.01 14.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 64.030000000000001 111.125 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.408 ' O ' ' C ' ' A' ' 37' ' ' GLY . . . -89.14 -175.62 4.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 63.32 111.159 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.408 ' C ' ' O ' ' A' ' 36' ' ' ALA . . . -37.59 -72.48 0.17 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.761 -0.733 . . . . 60.219999999999999 112.444 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -125.76 39.78 3.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.945 0.402 . . . . 75.439999999999998 110.933 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.9 mtpt -145.21 167.9 21.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 75.319999999999993 110.89 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 t -138.38 126.15 28.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 72.439999999999998 111.08 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.412 ' HB2' ' CG ' ' A' ' 34' ' ' LYS . 2.7 m-85 -90.49 139.56 30.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 74.319999999999993 110.967 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -132.99 167.59 20.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 74.329999999999998 110.894 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -152.47 130.72 12.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 72.310000000000002 110.912 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.404 ' C ' ' N ' ' A' ' 46' ' ' ASP . 2.0 t -44.35 106.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 74.430000000000007 110.869 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.5 ptt85 -44.05 -23.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 75.150000000000006 110.839 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.404 ' N ' ' C ' ' A' ' 44' ' ' CYS . 2.0 m-20 -85.31 31.31 0.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 74.129999999999995 110.834 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.406 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 3.9 tm0? -82.85 -23.63 33.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 73.25 110.921 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.62 -25.84 14.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 70.5 111.081 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.36 -52.8 3.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 74.430000000000007 110.806 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.497 HD11 ' CG ' ' A' ' 71' ' ' HIS . 54.3 mt -94.39 9.43 38.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 74.400000000000006 110.91 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 46.88 32.65 6.17 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.688 -0.768 . . . . 53.420000000000002 112.537 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 36.4 t -80.7 122.23 26.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.8 0.333 . . . . 73.450000000000003 110.88 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 26.1 mmm180 -101.5 37.21 1.85 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 74.329999999999998 110.869 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.1 t -88.77 119.65 29.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 73.540000000000006 110.862 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -117.02 146.92 42.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 74.030000000000001 110.88 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.405 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -139.4 164.85 28.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 70.109999999999999 111.029 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 61.4 mt -132.0 117.39 33.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.245 -0.434 . . . . 75.530000000000001 111.174 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.7 p -102.73 144.55 30.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 73.0 111.168 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.72 109.12 3.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 71.200000000000003 110.901 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.23 -102.86 2.65 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.818 -0.706 . . . . 64.409999999999997 112.505 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -127.51 4.78 6.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.723 0.297 . . . . 74.239999999999995 110.786 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.4 mtm180 -110.68 -175.57 2.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 74.109999999999999 110.8 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.469 HD11 ' CG ' ' A' ' 25' ' ' HIS . 18.7 tt -150.21 157.27 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 75.310000000000002 111.11 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.405 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 3.2 ttp -134.83 141.57 46.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 65.329999999999998 110.838 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 19.3 t -111.91 138.44 40.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.454 . . . . 71.430000000000007 111.163 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.1 mtt -105.65 -56.84 2.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 73.329999999999998 110.887 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.453 ' HD3' ' N ' ' A' ' 68' ' ' SER . 0.0 OUTLIER -118.74 144.48 46.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 71.239999999999995 110.835 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.453 ' N ' ' HD3' ' A' ' 67' ' ' ARG . 14.2 t -69.25 -179.6 1.65 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.479 . . . . 74.299999999999997 110.898 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.447 ' N ' ' OG ' ' A' ' 68' ' ' SER . 20.5 m-70 -109.27 145.76 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 74.319999999999993 110.852 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.7 t -93.4 6.19 49.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 71.019999999999996 110.848 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.497 ' CG ' HD11 ' A' ' 50' ' ' LEU . 26.2 p80 -137.32 165.63 25.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 70.299999999999997 110.911 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -100.42 150.31 36.84 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.61 0.719 . . . . 75.239999999999995 110.913 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.539 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.5 Cg_endo -69.74 158.86 55.53 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.664 2.243 . . . . 63.310000000000002 112.292 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -139.81 90.54 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.472 . . . . 63.140000000000001 110.871 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.8 mt -55.82 -14.23 2.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.232 -0.44 . . . . 70.430000000000007 110.909 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.4 -49.06 58.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 72.209999999999994 111.07 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.99 -32.94 34.57 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.746 -0.74 . . . . 72.040000000000006 112.487 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -67.79 -39.93 83.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 62.219999999999999 110.925 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -63.4 -24.8 68.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.134 -0.484 . . . . 73.400000000000006 110.91 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.22 70.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 74.409999999999997 111.097 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 50.3 mt -63.85 -51.67 63.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 73.230000000000004 110.909 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.408 ' HG3' ' CD2' ' A' ' 14' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 74.409999999999997 110.953 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.535 HD22 ' CZ ' ' A' ' 13' ' ' PHE . 13.5 tp . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.765 0.316 . . . . 72.439999999999998 110.924 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -112.59 140.74 47.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 75.540000000000006 110.971 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.535 ' CZ ' HD22 ' A' ' 11' ' ' LEU . 70.3 m-85 -139.84 172.91 12.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 75.510000000000005 110.887 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.436 ' O ' ' NE ' ' A' ' 21' ' ' ARG . 6.3 mt -151.78 162.5 40.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.132 -0.486 . . . . 75.430000000000007 110.841 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 74.420000000000002 110.842 179.915 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.436 ' NE ' ' O ' ' A' ' 14' ' ' LEU . 5.9 tpt180 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.85 0.357 . . . . 71.420000000000002 110.88 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -105.43 160.53 15.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 73.200000000000003 110.925 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.3 tp -119.66 125.27 48.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 71.510000000000005 110.936 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.412 ' CG2' HD12 ' A' ' 14' ' ' LEU . 20.9 t -106.15 123.0 60.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 72.530000000000001 111.162 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.48 ' CG ' HD13 ' A' ' 63' ' ' ILE . 64.9 t60 -153.02 138.77 17.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.138 -0.483 . . . . 75.329999999999998 110.877 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 54.82 24.68 5.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 74.340000000000003 110.878 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m 75.24 26.63 1.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.487 . . . . 72.010000000000005 110.903 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -124.94 -176.07 3.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 74.319999999999993 110.899 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.602 ' C ' ' CD1' ' A' ' 30' ' ' TYR . 56.0 mt -128.98 147.56 50.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 71.239999999999995 110.888 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.602 ' CD1' ' C ' ' A' ' 29' ' ' LEU . 1.0 OUTLIER -144.77 173.75 11.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 75.349999999999994 110.915 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -135.59 141.91 45.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.126 -0.488 . . . . 73.549999999999997 110.887 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.2 tttm -64.35 115.51 5.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 73.239999999999995 110.882 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -92.91 -57.18 2.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 71.340000000000003 110.926 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -150.6 179.04 8.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.487 . . . . 71.019999999999996 110.951 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -136.88 117.73 14.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 74.0 111.177 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.57 -175.57 3.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 75.420000000000002 111.04 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -48.97 94.36 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.72 -0.752 . . . . 71.239999999999995 112.494 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 62.51 34.59 15.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.934 0.397 . . . . 73.230000000000004 110.887 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -145.33 158.03 43.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 74.310000000000002 110.885 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.1 t -138.25 114.17 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 75.040000000000006 111.114 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -78.69 146.07 34.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 74.319999999999993 110.914 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.5 m95 -135.88 151.85 50.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.079 -0.509 . . . . 72.310000000000002 110.905 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -134.93 129.82 34.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 72.409999999999997 110.895 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.6 t -42.81 116.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 74.450000000000003 110.859 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.453 ' CZ ' HD11 ' A' ' 29' ' ' LEU . 18.3 ptt180 -55.14 -20.55 10.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 74.530000000000001 110.874 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.54 36.44 0.54 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 65.0 110.854 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -88.43 -18.88 27.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.143 -0.48 . . . . 74.519999999999996 110.913 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.12 -31.05 12.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 73.010000000000005 111.144 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.0 ttm-85 -95.05 -57.36 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 71.230000000000004 110.811 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.546 HD11 ' CD2' ' A' ' 71' ' ' HIS . 22.6 mt -95.61 22.65 6.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 63.200000000000003 110.915 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.94 29.66 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.687 -0.768 . . . . 73.230000000000004 112.466 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.475 ' N ' ' O ' ' A' ' 50' ' ' LEU . 4.7 t -75.76 127.66 33.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.844 0.354 . . . . 74.209999999999994 110.852 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.33 -10.92 17.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 74.319999999999993 110.844 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 m -39.32 128.26 1.8 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.229 -0.441 . . . . 74.120000000000005 110.86 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.41 ' C ' ' HG3' ' A' ' 66' ' ' MET . 16.0 mtt85 -123.82 166.03 16.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 74.430000000000007 110.842 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -149.72 156.51 41.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 75.049999999999997 111.075 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 91.0 mt -125.42 122.49 62.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 71.109999999999999 111.121 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.3 p -101.1 142.43 32.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 74.319999999999993 111.128 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.95 87.17 2.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 73.129999999999995 110.95 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.45 -85.23 1.56 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.721 -0.752 . . . . 73.319999999999993 112.486 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.89 -1.24 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.771 0.32 . . . . 63.310000000000002 110.855 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.434 ' CZ ' ' CB ' ' A' ' 62' ' ' ARG . 1.4 mtp-105 -102.71 174.39 5.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 73.120000000000005 110.888 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.48 HD13 ' CG ' ' A' ' 25' ' ' HIS . 4.9 tt -145.06 154.14 14.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 75.049999999999997 111.114 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.456 ' N ' HG12 ' A' ' 63' ' ' ILE . 9.4 ttp -138.16 142.66 40.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.149 -0.478 . . . . 75.420000000000002 110.882 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.1 t -95.14 145.03 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 74.329999999999998 111.067 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.41 ' HG3' ' C ' ' A' ' 55' ' ' ARG . 31.0 mtp -104.77 -61.04 1.51 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.088 -0.505 . . . . 74.310000000000002 110.783 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -123.02 162.65 21.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 74.109999999999999 110.888 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.34 153.91 29.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 51.229999999999997 110.86 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -92.37 137.86 32.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.099 -0.5 . . . . 75.230000000000004 110.848 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 51.9 t -89.48 10.1 24.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 72.25 110.865 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.546 ' CD2' HD11 ' A' ' 50' ' ' LEU . 31.8 p80 -136.93 142.81 42.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 73.5 110.801 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -79.8 155.59 75.49 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.587 0.708 . . . . 74.230000000000004 110.914 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.66 155.86 65.14 Favored 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.743 2.295 . . . . 74.150000000000006 112.365 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -133.14 80.37 1.88 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 70.409999999999997 110.884 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.433 ' N ' HD22 ' A' ' 75' ' ' LEU . 3.4 mt -45.78 -23.85 0.31 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.234 -0.439 . . . . 74.209999999999994 110.848 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.57 -43.18 73.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 73.319999999999993 111.088 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -77.99 -36.8 30.94 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.753 -0.737 . . . . 70.040000000000006 112.465 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tp -69.64 -37.39 76.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.741 0.305 . . . . 75.209999999999994 110.94 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -68.98 -29.44 67.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 74.140000000000001 110.904 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.63 93.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.1 -0.5 . . . . 64.120000000000005 111.102 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 61.4 mt -67.98 -46.96 69.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.23 -0.441 . . . . 73.349999999999994 110.966 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.8 mtp-105 . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.791 179.97 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.564 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 28.8 tp . . . . . 0 N--CA 1.458 -0.036 0 CA-C-O 120.77 0.319 . . . . 73.230000000000004 110.951 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -98.15 147.47 24.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.463 . . . . 73.200000000000003 110.858 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.564 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 52.3 m-85 -136.68 172.86 12.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 63.049999999999997 110.874 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.0 mt -147.51 158.29 43.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 72.450000000000003 110.923 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 74.400000000000006 110.876 179.939 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.6 ttt85 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.851 0.358 . . . . 74.439999999999998 110.915 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.558 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -100.99 170.73 8.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 73.0 110.855 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.442 HD11 ' CD2' ' A' ' 13' ' ' PHE . 4.3 tp -139.1 138.17 36.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 72.310000000000002 110.93 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 18.1 t -104.26 126.55 58.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 72.5 111.093 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.674 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 5.2 t60 -159.73 132.28 6.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.128 -0.487 . . . . 72.230000000000004 110.844 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 53.17 37.79 25.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 72.129999999999995 110.9 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 72.1 m 63.05 26.7 15.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 74.150000000000006 110.857 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -126.68 164.11 22.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 73.530000000000001 110.807 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.461 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 62.6 mt -115.3 137.64 51.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 72.530000000000001 110.867 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.523 ' CE1' ' HB3' ' A' ' 25' ' ' HIS . 1.6 m-85 -127.16 168.02 15.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 71.409999999999997 110.995 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.558 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 12.4 mtp-105 -128.72 118.38 22.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 72.040000000000006 110.893 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.446 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 32.8 tttm -41.57 116.6 0.79 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.444 . . . . 70.239999999999995 110.836 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -91.5 -54.34 3.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.219 -0.446 . . . . 74.099999999999994 110.906 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.91 -178.19 6.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 74.239999999999995 110.894 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.89 135.19 20.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 62.25 111.13 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -104.81 36.49 2.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 53.350000000000001 111.076 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.25 -63.27 4.45 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.722 -0.751 . . . . 74.239999999999995 112.43 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -101.75 -26.87 13.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.964 0.411 . . . . 73.430000000000007 110.866 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.9 mtmp? -105.4 159.91 15.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.483 . . . . 75.310000000000002 110.86 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.4 t -137.57 116.75 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 74.439999999999998 111.179 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.525 ' CE2' HD13 ' A' ' 57' ' ' ILE . 3.4 m-85 -80.75 145.9 31.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 73.200000000000003 110.954 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.446 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 77.1 m95 -137.29 148.7 46.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 74.010000000000005 110.874 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 12.2 ptt? -131.62 126.88 35.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 63.530000000000001 110.843 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -42.54 120.78 1.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 74.310000000000002 110.85 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.461 ' CZ ' HD13 ' A' ' 29' ' ' LEU . 19.8 ptt180 -53.02 -17.84 1.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 73.209999999999994 110.884 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -87.88 17.45 4.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 73.439999999999998 110.903 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.41 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -78.49 -15.5 58.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.227 -0.442 . . . . 74.25 110.888 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -96.76 -32.85 11.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 73.329999999999998 111.05 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -98.38 -62.51 1.23 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 74.5 110.843 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.561 HD12 ' CD2' ' A' ' 71' ' ' HIS . 31.6 mt -83.12 15.45 2.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 62.109999999999999 110.922 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.61 33.54 1.55 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.789 -0.72 . . . . 71.510000000000005 112.429 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.1 t -77.75 108.91 11.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.8 0.333 . . . . 75.140000000000001 110.92 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -84.35 12.56 6.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 74.310000000000002 110.856 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.1 t -60.22 113.41 2.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 75.450000000000003 110.874 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.6 mtm180 -119.34 137.94 53.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 75.540000000000006 110.867 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -126.6 160.43 30.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 75.239999999999995 111.132 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.525 HD13 ' CE2' ' A' ' 41' ' ' TYR . 31.6 mt -128.23 128.36 68.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 74.099999999999994 111.158 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.441 HG22 ' NE1' ' A' ' 42' ' ' TRP . 19.3 p -101.95 147.39 26.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 74.120000000000005 111.205 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -142.83 106.89 4.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 72.430000000000007 110.875 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 69.93 -92.86 0.39 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.744 -0.741 . . . . 75.010000000000005 112.51 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -128.82 6.91 5.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.772 0.32 . . . . 75.310000000000002 110.887 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 39.4 mtp85 -108.03 -175.93 2.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.287 -0.415 . . . . 75.140000000000001 110.867 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.528 HD12 ' CD2' ' A' ' 25' ' ' HIS . 9.8 tt -150.35 153.41 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 74.310000000000002 111.104 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 68.2 mtm -135.92 146.88 47.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 71.400000000000006 110.832 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.674 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 17.2 t -116.51 132.23 66.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 73.450000000000003 111.13 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mmm -92.02 -58.55 2.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 71.450000000000003 110.891 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -118.44 160.19 22.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 74.040000000000006 110.861 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.2 m -78.62 -179.71 6.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 61.100000000000001 110.76 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -108.26 139.83 42.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.105 -0.498 . . . . 62.420000000000002 110.814 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.1 t -94.52 15.91 16.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 54.140000000000001 110.922 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.561 ' CD2' HD12 ' A' ' 50' ' ' LEU . 24.3 p80 -145.25 150.89 37.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.144 -0.48 . . . . 71.530000000000001 110.826 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -81.07 152.43 71.32 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.579 0.704 . . . . 62.210000000000001 110.964 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 149.61 67.36 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.708 2.272 . . . . 73.109999999999999 112.372 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.33 81.42 1.89 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.271 -0.422 . . . . 52.119999999999997 110.837 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 34.7 mt -53.95 -23.48 13.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 73.519999999999996 110.971 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.0 -45.71 66.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 63.149999999999999 111.147 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.01 -31.38 43.41 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.728 -0.749 . . . . 53.210000000000001 112.519 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tp -70.68 -38.3 73.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.723 0.297 . . . . 74.340000000000003 110.911 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -68.55 -23.46 64.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.254 -0.43 . . . . 74.439999999999998 110.849 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.55 -44.57 86.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 73.120000000000005 111.077 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.2 mt -69.92 -50.35 42.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 75.209999999999994 110.885 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 50.3 mtp180 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 74.319999999999993 110.879 179.938 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.51 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 24.5 tp . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.703 0.287 . . . . 74.430000000000007 110.968 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 -101.24 152.87 20.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.212 -0.449 . . . . 61.109999999999999 110.942 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.51 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 61.6 m-85 -137.93 169.93 16.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 110.832 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.1 mt -145.08 165.21 28.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 71.430000000000007 110.956 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 71.329999999999998 110.899 179.872 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.5 tpt85 . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.831 0.348 . . . . 73.409999999999997 110.813 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.474 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -103.55 165.54 10.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 74.120000000000005 110.878 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.4 tp -130.4 135.13 47.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 72.040000000000006 110.946 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.499 ' CG1' ' NH2' ' A' ' 82' ' ' ARG . 68.0 t -101.85 116.92 46.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 73.329999999999998 111.072 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.596 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 10.7 t60 -152.83 127.03 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 75.420000000000002 110.874 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 59.89 43.43 14.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 72.200000000000003 110.867 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.438 ' OG ' ' CD2' ' A' ' 75' ' ' LEU . 1.4 t 56.89 20.11 5.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.122 -0.49 . . . . 74.019999999999996 110.88 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.463 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 20.1 m-85 -116.52 -177.38 3.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 74.209999999999994 110.928 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 65.8 mt -134.14 134.08 41.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 74.310000000000002 110.897 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.511 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -125.93 172.03 10.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 75.310000000000002 110.956 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.474 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 59.4 mtp180 -131.7 129.08 40.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 73.540000000000006 110.924 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.43 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 51.6 tttm -54.86 122.07 9.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 73.310000000000002 110.934 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -94.06 -54.81 3.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 64.349999999999994 110.903 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.05 164.57 37.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.5 . . . . 75.120000000000005 110.846 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.48 131.98 54.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.439 . . . . 72.450000000000003 111.096 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -101.97 37.13 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.288 -0.414 . . . . 74.319999999999993 111.12 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.98 -73.39 2.31 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.682 -0.771 . . . . 62.009999999999998 112.453 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -102.95 -11.28 18.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 73.450000000000003 110.9 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 27.5 mtmm -115.38 156.57 25.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 73.409999999999997 110.897 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.0 t -133.79 114.42 19.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 74.439999999999998 111.144 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.427 ' CE2' HD11 ' A' ' 57' ' ' ILE . 7.2 m-85 -77.74 149.06 34.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 74.310000000000002 110.967 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.43 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 77.2 m95 -139.84 165.21 27.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 75.519999999999996 110.952 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 19.4 ptt? -151.45 133.58 15.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 73.549999999999997 110.845 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.7 t -46.22 118.17 1.82 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 75.150000000000006 110.88 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 41.6 ptt85 -52.06 -23.89 5.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 74.400000000000006 110.878 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -81.98 12.34 4.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 71.430000000000007 110.788 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.415 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 5.3 tm0? -71.46 -17.45 62.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.184 -0.462 . . . . 75.150000000000006 110.931 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.15 -36.76 11.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 74.239999999999995 111.109 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.3 mtt85 -93.54 -62.75 1.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 74.239999999999995 110.886 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.504 HD12 ' CD2' ' A' ' 71' ' ' HIS . 39.7 mt -84.25 18.32 2.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.469 . . . . 72.420000000000002 110.849 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.48 38.63 0.29 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.771 -0.728 . . . . 71.209999999999994 112.497 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 32.7 t -78.2 102.32 7.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.819 0.342 . . . . 72.310000000000002 110.865 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -81.91 45.61 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 73.0 110.913 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.8 t -100.04 111.7 23.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 71.040000000000006 110.921 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -107.17 161.07 15.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 73.219999999999999 110.921 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -149.86 162.6 39.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.257 -0.428 . . . . 72.150000000000006 111.116 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.427 HD11 ' CE2' ' A' ' 41' ' ' TYR . 74.6 mt -134.26 125.34 47.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 74.219999999999999 111.151 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.2 p -101.58 150.84 22.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.451 . . . . 73.209999999999994 111.15 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -147.71 112.97 5.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 74.150000000000006 110.954 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 65.25 -92.75 0.15 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.796 -0.716 . . . . 72.420000000000002 112.558 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.46 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -128.94 2.49 5.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.811 0.338 . . . . 75.200000000000003 110.883 -179.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.1 mtt85 -102.33 -175.31 2.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 73.420000000000002 110.796 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 20.4 tt -151.0 156.35 6.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 72.519999999999996 111.118 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 49.3 mtm -136.49 149.05 47.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.451 . . . . 74.319999999999993 110.894 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.596 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 90.5 t -121.55 133.89 66.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 73.540000000000006 111.121 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.4 mtp -93.56 -63.43 1.2 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.14 -0.482 . . . . 75.549999999999997 110.834 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -112.82 167.95 10.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 74.349999999999994 110.854 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.5 m -84.99 -177.55 6.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 74.120000000000005 110.883 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -110.04 137.87 47.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 73.409999999999997 110.903 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.6 t -91.79 13.96 16.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 71.340000000000003 110.872 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.504 ' CD2' HD12 ' A' ' 50' ' ' LEU . 24.0 p80 -143.8 159.33 42.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 74.209999999999994 110.825 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -90.83 153.87 45.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.609 0.719 . . . . 73.430000000000007 110.891 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.463 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.3 Cg_endo -69.83 139.46 40.04 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.716 2.277 . . . . 73.420000000000002 112.289 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 77' ' ' GLY . 13.1 t0 -101.27 79.35 1.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 74.049999999999997 110.874 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.438 ' CD2' ' OG ' ' A' ' 27' ' ' SER . 7.9 mt -46.88 -24.64 0.62 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 73.109999999999999 110.935 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.66 -26.29 19.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 73.340000000000003 111.124 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 74' ' ' ASP . . . -84.07 -46.62 5.84 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.738 -0.744 . . . . 74.049999999999997 112.496 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.4 tp -67.71 -35.63 79.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 73.329999999999998 110.914 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -72.26 -31.44 65.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.161 -0.472 . . . . 62.340000000000003 110.952 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.72 -44.88 95.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 65.400000000000006 111.123 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.6 mt -60.18 -41.38 92.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.978 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.499 ' NH2' ' CG1' ' A' ' 24' ' ' VAL . 10.7 mtt180 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.145 -0.48 . . . . 75.439999999999998 110.901 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.431 HD21 ' CE1' ' A' ' 13' ' ' PHE . 20.4 tp . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.701 0.286 . . . . 75.5 110.944 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -105.31 148.28 27.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 71.540000000000006 110.88 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.46 ' CD1' HD13 ' A' ' 23' ' ' LEU . 28.9 m-85 -139.81 172.86 12.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.128 -0.487 . . . . 74.239999999999995 110.863 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.436 ' CD2' ' HA ' ' A' ' 82' ' ' ARG . 6.3 mt -150.65 118.51 6.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.138 -0.483 . . . . 71.239999999999995 110.926 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.5 mtp180 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.040000000000006 110.832 179.972 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.459 ' HD3' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.895 0.379 . . . . 74.409999999999997 110.825 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.459 ' N ' ' HD3' ' A' ' 21' ' ' ARG . 2.6 m-85 -126.32 157.48 38.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 73.540000000000006 110.9 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.46 HD13 ' CD1' ' A' ' 13' ' ' PHE . 15.7 tp -120.58 116.47 25.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.152 -0.476 . . . . 75.409999999999997 110.979 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.8 t -90.88 114.52 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 75.319999999999993 111.074 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.476 ' CG ' HD11 ' A' ' 63' ' ' ILE . 6.9 t60 -151.6 127.13 10.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.138 -0.483 . . . . 71.439999999999998 110.868 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 62.97 38.51 11.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 72.120000000000005 110.897 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 m 60.03 29.19 18.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.091 -0.504 . . . . 74.439999999999998 110.855 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -130.48 178.15 6.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 64.150000000000006 110.882 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.415 ' HB2' ' NH1' ' A' ' 45' ' ' ARG . 32.1 mt -130.43 132.76 45.88 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.093 -0.503 . . . . 73.200000000000003 110.883 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.523 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -127.28 167.53 16.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 73.439999999999998 110.907 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.2 mtp180 -126.96 138.92 53.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.119 -0.492 . . . . 74.420000000000002 110.856 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 25.2 tttm -59.51 116.76 4.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 75.099999999999994 110.884 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -91.63 -52.93 4.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 75.409999999999997 110.86 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.64 ' NZ ' ' CD2' ' A' ' 41' ' ' TYR . 1.8 pttm -160.53 177.84 10.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 74.239999999999995 110.862 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.33 120.02 14.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 52.43 111.026 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.27 38.16 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.481 . . . . 54.32 111.082 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 102.73 -89.13 0.7 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.728 -0.749 . . . . 74.049999999999997 112.468 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -96.72 -4.43 40.74 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.825 0.345 . . . . 72.140000000000001 110.823 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -113.7 158.61 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 73.530000000000001 110.855 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 t -136.26 119.24 22.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 72.129999999999995 111.107 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.64 ' CD2' ' NZ ' ' A' ' 34' ' ' LYS . 3.3 m-85 -81.31 151.19 28.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 71.209999999999994 110.941 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.511 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 75.4 m95 -141.49 146.32 36.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 73.530000000000001 110.912 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.7 ptt? -129.26 144.56 51.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 73.420000000000002 110.871 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -55.13 108.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.432 . . . . 70.230000000000004 110.887 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.415 ' NH1' ' HB2' ' A' ' 29' ' ' LEU . 18.9 ptt-85 -39.98 -30.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 74.329999999999998 110.9 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -77.88 51.91 0.99 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 71.319999999999993 110.849 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -75.49 -51.8 12.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.252 -0.431 . . . . 71.109999999999999 110.909 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -98.0 -13.9 20.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 64.219999999999999 111.064 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 mmt-85 -81.82 -61.15 2.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 74.109999999999999 110.906 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.47 HD13 ' CD2' ' A' ' 71' ' ' HIS . 16.3 mt -108.01 26.75 9.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 74.319999999999993 110.928 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 38.4 42.45 1.31 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.789 -0.72 . . . . 75.349999999999994 112.469 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.7 t -96.32 130.01 43.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.79 0.328 . . . . 74.340000000000003 110.88 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -111.83 17.78 19.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.474 . . . . 71.420000000000002 110.841 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.9 t -69.51 127.88 34.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 72.030000000000001 110.832 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -121.62 173.15 7.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 75.109999999999999 110.899 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.45 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -155.52 163.76 39.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.466 . . . . 75.430000000000007 111.108 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 97.7 mt -128.37 121.71 56.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 64.439999999999998 111.089 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.429 HG22 ' CD1' ' A' ' 42' ' ' TRP . 20.1 p -101.08 151.27 22.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 74.329999999999998 111.151 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.18 113.14 2.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.465 . . . . 72.129999999999995 110.866 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 73.48 -101.11 1.13 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.793 -0.718 . . . . 73.510000000000005 112.486 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.408 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -127.06 7.12 6.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.736 0.303 . . . . 75.230000000000004 110.861 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.06 -175.42 2.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 75.400000000000006 110.868 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.476 HD11 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.89 162.72 3.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 73.510000000000005 111.102 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.461 ' N ' HG12 ' A' ' 63' ' ' ILE . 1.5 ttp -143.5 148.84 36.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 75.120000000000005 110.889 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.415 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 21.6 t -113.64 144.38 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.426 . . . . 74.400000000000006 111.093 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 14.3 mtp -104.67 -61.61 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 74.129999999999995 110.895 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 52.9 mtt-85 -111.44 170.73 7.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 73.409999999999997 110.892 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 80.6 p -88.88 -177.91 5.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 75.310000000000002 110.858 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -116.01 138.96 50.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.067 -0.515 . . . . 74.299999999999997 110.866 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 4.3 t -90.98 8.35 35.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 74.349999999999994 110.837 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.47 ' CD2' HD13 ' A' ' 50' ' ' LEU . 26.5 p80 -135.59 157.76 46.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 75.230000000000004 110.792 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -91.62 151.79 42.76 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.568 0.699 . . . . 74.409999999999997 110.878 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 150.24 67.73 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.682 2.255 . . . . 75.209999999999994 112.347 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.56 81.37 1.97 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.231 -0.44 . . . . 74.129999999999995 110.913 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.452 HD22 ' N ' ' A' ' 75' ' ' LEU . 6.0 mt -48.25 -28.28 2.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 71.530000000000001 110.96 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.64 77.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 71.519999999999996 111.143 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.98 -29.23 59.25 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.741 -0.742 . . . . 72.519999999999996 112.516 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.1 tp -76.72 -41.09 46.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.761 0.315 . . . . 74.230000000000004 110.914 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -75.52 -23.43 56.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 71.209999999999994 110.908 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.92 -18.4 47.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 75.109999999999999 111.067 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.0 mt -80.56 -41.48 24.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 73.5 110.884 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.436 ' HA ' ' CD2' ' A' ' 14' ' ' LEU . 14.8 mtm180 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 75.209999999999994 110.854 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.5 tp . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.746 0.308 . . . . 75.120000000000005 110.925 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -98.65 159.9 14.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 71.230000000000004 110.853 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -139.31 171.9 13.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.475 . . . . 73.310000000000002 110.861 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.491 ' O ' ' N ' ' A' ' 22' ' ' PHE . 11.4 mt -148.16 128.14 13.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.126 -0.488 . . . . 74.549999999999997 110.967 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.1 mtp-105 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 74.319999999999993 110.875 179.962 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.0 ttm180 . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.86 0.362 . . . . 72.420000000000002 110.899 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.491 ' N ' ' O ' ' A' ' 14' ' ' LEU . 3.0 m-85 -143.76 158.52 43.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 75.340000000000003 110.842 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 12.8 tp -126.46 115.85 20.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 75.109999999999999 110.903 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.41 ' CG2' HD11 ' A' ' 14' ' ' LEU . 59.4 t -89.56 122.79 41.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 75.129999999999995 111.111 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.514 ' CG ' HD11 ' A' ' 63' ' ' ILE . 33.7 t60 -161.3 134.04 6.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 64.239999999999995 110.907 179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.492 ' HG2' ' CE1' ' A' ' 25' ' ' HIS . 40.4 mm-40 60.19 29.7 19.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 75.310000000000002 110.905 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.7 m 65.74 27.71 11.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 74.420000000000002 110.845 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.535 ' CE2' ' CD2' ' A' ' 69' ' ' HIS . 16.6 m-85 -126.07 -174.26 3.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 74.299999999999997 110.963 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.423 HD11 ' CZ ' ' A' ' 45' ' ' ARG . 40.7 mt -135.31 130.9 35.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.219999999999999 110.898 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.468 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 2.0 m-85 -127.42 159.42 34.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.137 -0.483 . . . . 75.239999999999995 110.922 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.474 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 3.7 mtt-85 -116.33 148.8 40.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.103 -0.499 . . . . 74.140000000000001 110.873 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 41.3 tttp -71.13 109.12 4.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 71.420000000000002 110.916 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.475 ' C ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -83.78 -59.6 2.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.432 . . . . 70.099999999999994 110.898 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -153.85 -176.37 5.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 75.329999999999998 110.884 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -137.9 119.75 15.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 71.109999999999999 111.109 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.434 ' O ' ' N ' ' A' ' 38' ' ' GLU . . . -102.41 -174.73 2.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.31 -0.404 . . . . 75.239999999999995 111.157 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -45.35 93.16 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.722 -0.752 . . . . 73.209999999999994 112.506 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 36' ' ' ALA . 22.0 mt-10 58.68 40.53 23.22 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.905 0.383 . . . . 64.0 110.926 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.5 mtmm -150.93 157.93 43.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 65.019999999999996 110.845 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.5 t -135.13 117.45 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.172 -0.467 . . . . 71.439999999999998 111.175 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -82.3 135.02 35.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 75.109999999999999 110.935 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.464 ' NE1' HG22 ' A' ' 58' ' ' THR . 75.2 m95 -123.97 161.89 24.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.125 -0.489 . . . . 75.510000000000005 110.962 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -146.12 127.18 14.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.28 -0.418 . . . . 74.200000000000003 110.897 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.5 t -41.67 112.43 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.298 -0.41 . . . . 72.120000000000005 110.88 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.474 ' HB2' ' CZ ' ' A' ' 31' ' ' ARG . 19.8 ptt180 -42.28 -46.85 4.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 65.030000000000001 110.894 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.472 ' HB2' ' CG ' ' A' ' 50' ' ' LEU . 0.1 OUTLIER -80.07 56.7 2.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.182 -0.463 . . . . 75.200000000000003 110.82 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.417 ' OE1' ' CA ' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -88.99 -38.75 14.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 75.219999999999999 110.88 -179.906 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.417 ' CA ' ' OE1' ' A' ' 47' ' ' GLN . . . -89.12 -68.97 0.74 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 74.319999999999993 111.099 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -41.64 -61.87 1.0 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.319999999999993 110.801 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.472 ' CG ' ' HB2' ' A' ' 46' ' ' ASP . 23.4 mt -77.75 -18.93 55.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 74.230000000000004 110.898 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.96 37.85 28.28 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.75 -0.738 . . . . 64.239999999999995 112.452 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.4 t -90.68 143.87 26.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.839 0.352 . . . . 63.009999999999998 110.887 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.8 mmt85 -125.54 31.49 5.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 74.439999999999998 110.906 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.7 t -88.7 137.58 32.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 64.430000000000007 110.897 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -125.63 141.87 51.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 75.329999999999998 110.938 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.46 152.11 51.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 72.099999999999994 111.095 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.51 ' CG2' ' N ' ' A' ' 58' ' ' THR . 91.8 mt -117.64 162.24 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 74.530000000000001 111.141 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.51 ' N ' ' CG2' ' A' ' 57' ' ' ILE . 43.2 p -141.0 136.89 32.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 74.200000000000003 111.211 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.404 ' HG3' ' C ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -146.56 109.43 4.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 75.549999999999997 110.874 179.995 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 79.16 -101.03 1.81 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.763 -0.732 . . . . 74.329999999999998 112.45 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -128.96 9.17 5.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.735 0.302 . . . . 74.25 110.841 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -112.71 -179.82 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 75.510000000000005 110.826 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.514 HD11 ' CG ' ' A' ' 25' ' ' HIS . 14.4 tt -146.64 159.83 10.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 75.409999999999997 111.142 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.406 ' N ' HG12 ' A' ' 63' ' ' ILE . 36.5 mtm -139.73 152.28 46.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 73.519999999999996 110.843 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.459 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 50.3 t -119.62 139.58 46.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.219 -0.446 . . . . 72.540000000000006 111.135 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mmm -97.97 -51.79 3.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 74.319999999999993 110.868 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -128.13 172.74 10.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 72.209999999999994 110.902 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 51.0 p -87.68 -179.04 6.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 72.209999999999994 110.861 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.535 ' CD2' ' CE2' ' A' ' 28' ' ' PHE . 86.4 m-70 -111.05 136.56 49.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 65.120000000000005 110.902 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.5 p -79.45 -4.17 49.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 72.430000000000007 110.862 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.449 ' NE2' ' OD1' ' A' ' 46' ' ' ASP . 12.0 p80 -121.97 178.98 4.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 110.839 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -109.36 150.21 40.8 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.654 0.74 . . . . 54.140000000000001 110.873 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.76 155.29 66.32 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.668 2.246 . . . . 34.310000000000002 112.356 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -136.8 100.04 4.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.258 -0.428 . . . . 64.319999999999993 110.881 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mt -63.94 -21.42 66.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 73.340000000000003 110.875 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -76.51 -61.98 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 75.400000000000006 111.138 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.17 -33.49 64.92 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.763 -0.732 . . . . 74.409999999999997 112.512 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 tp -72.79 -48.1 40.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.775 0.321 . . . . 75.099999999999994 110.948 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -59.73 -29.1 67.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.451 . . . . 74.420000000000002 110.832 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.33 96.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 64.150000000000006 111.132 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 mt -75.96 -26.37 56.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.283 -0.417 . . . . 73.25 110.972 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 72.7 mtp85 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 72.540000000000006 110.905 179.928 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.562 HD22 ' CZ ' ' A' ' 13' ' ' PHE . 33.8 tp . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.824 0.345 . . . . 73.120000000000005 110.91 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -105.33 151.9 23.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.183 -0.462 . . . . 72.530000000000001 110.891 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.562 ' CZ ' HD22 ' A' ' 11' ' ' LEU . 66.4 m-85 -139.79 172.89 12.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 72.209999999999994 110.891 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.506 ' CD1' ' CG2' ' A' ' 24' ' ' VAL . 5.2 mt -147.27 156.5 42.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 65.299999999999997 110.881 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.0 tpp85 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 74.409999999999997 110.806 179.971 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.791 0.329 . . . . 74.109999999999999 110.864 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.436 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -99.61 167.78 10.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 74.519999999999996 110.893 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.0 tp -134.38 132.66 39.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 74.239999999999995 110.905 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.506 ' CG2' ' CD1' ' A' ' 14' ' ' LEU . 55.8 t -98.44 113.35 32.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 74.340000000000003 111.128 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.636 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 6.2 t60 -149.43 122.67 8.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 74.319999999999993 110.838 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 63.46 47.74 3.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.156 -0.474 . . . . 75.140000000000001 110.938 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.96 25.54 3.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 61.420000000000002 110.871 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.402 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 20.7 m-85 -123.28 -179.17 4.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.082 -0.508 . . . . 74.129999999999995 110.903 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.6 mt -131.34 139.09 49.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.186 -0.461 . . . . 74.019999999999996 110.949 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.508 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -133.16 159.64 39.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.465 . . . . 72.420000000000002 110.924 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.436 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -123.47 124.57 43.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 75.25 110.912 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -46.37 112.94 0.55 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 70.230000000000004 110.838 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -90.35 -53.38 4.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 72.030000000000001 110.885 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.3 ptmm? -161.25 -176.61 5.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -143.67 133.3 23.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.27 -0.423 . . . . 71.109999999999999 111.075 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -109.82 69.14 0.69 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 64.109999999999999 111.079 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.77 -101.08 2.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.72 -0.752 . . . . 43.240000000000002 112.533 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -101.54 1.18 37.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.87 0.367 . . . . 70.540000000000006 110.924 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -112.58 143.69 43.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.117 -0.492 . . . . 74.510000000000005 110.876 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.89 119.6 60.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 72.510000000000005 111.069 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.426 ' N ' ' CD1' ' A' ' 41' ' ' TYR . 6.5 m-30 -78.52 144.59 35.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.201 -0.454 . . . . 72.430000000000007 110.971 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -136.08 123.09 21.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 71.420000000000002 110.939 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.8 ptt? -106.84 139.75 40.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 64.129999999999995 110.894 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.0 t -54.03 115.54 2.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 73.420000000000002 110.907 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 21.7 ptt-85 -41.59 -34.54 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 75.310000000000002 110.834 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -82.82 45.49 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 72.099999999999994 110.852 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -87.28 -27.97 22.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 75.230000000000004 110.937 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.85 -25.45 15.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 64.099999999999994 111.094 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 23.7 ttm-85 -90.8 -59.97 2.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 74.310000000000002 110.87 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.442 ' O ' ' N ' ' A' ' 52' ' ' CYS . 37.8 mt -96.53 22.7 7.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.2 -0.454 . . . . 73.430000000000007 110.888 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 37.76 29.63 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.822 -0.704 . . . . 75.340000000000003 112.536 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.442 ' N ' ' O ' ' A' ' 50' ' ' LEU . 4.7 t -80.92 99.32 8.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.827 0.346 . . . . 72.010000000000005 110.871 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 30.3 mmm-85 -80.6 7.38 10.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 74.25 110.869 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.9 t -54.82 110.92 0.72 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 54.420000000000002 110.83 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -112.36 166.97 10.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 64.409999999999997 110.916 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -148.36 166.67 27.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 63.450000000000003 111.11 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.406 HG12 ' CD1' ' A' ' 41' ' ' TYR . 86.8 mt -132.47 123.58 50.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 75.340000000000003 111.063 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 49.1 p -102.91 153.5 20.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.48 . . . . 72.319999999999993 111.161 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -153.12 109.82 3.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 70.120000000000005 110.857 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 71.46 -96.73 0.65 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.703 -0.761 . . . . 72.319999999999993 112.505 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.465 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -128.07 9.17 6.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.328 . . . . 71.140000000000001 110.857 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.42 ' NH1' ' HB3' ' A' ' 62' ' ' ARG . 14.8 mtp-105 -110.99 -176.92 3.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 73.439999999999998 110.858 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.436 HD11 ' CG ' ' A' ' 25' ' ' HIS . 19.4 tt -148.03 160.58 7.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.454 . . . . 74.420000000000002 111.072 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 8.1 ttp -142.53 148.44 37.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 74.420000000000002 110.847 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.636 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 93.4 t -118.57 141.97 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 74.310000000000002 111.091 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.433 ' N ' HG13 ' A' ' 65' ' ' VAL . 9.4 mmm -105.59 -61.93 1.43 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 60.210000000000001 110.886 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.405 ' HD3' ' N ' ' A' ' 68' ' ' SER . 1.9 tmt_? -114.03 148.61 36.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 75.010000000000005 110.875 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.405 ' N ' ' HD3' ' A' ' 67' ' ' ARG . 13.7 p -68.73 -175.5 0.7 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 73.150000000000006 110.906 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -112.07 142.86 43.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 74.200000000000003 110.812 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.3 t -92.39 9.16 35.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 73.099999999999994 110.807 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.429 ' CD2' HD13 ' A' ' 50' ' ' LEU . 28.5 p80 -138.97 161.3 37.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 71.019999999999996 110.835 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -94.23 155.43 39.93 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.609 0.718 . . . . 73.420000000000002 110.945 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.402 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 54.1 Cg_endo -69.82 155.55 65.43 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.709 2.273 . . . . 71.299999999999997 112.32 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -134.46 80.25 1.84 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 73.25 110.83 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -46.57 -24.16 0.49 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 75.209999999999994 110.947 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.53 -50.97 32.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.143 -0.481 . . . . 74.310000000000002 111.131 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.32 -37.88 80.62 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.679 -0.772 . . . . 64.140000000000001 112.473 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.0 tp -69.7 -41.8 74.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.779 0.323 . . . . 72.209999999999994 110.918 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -60.96 -23.3 65.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.137 -0.483 . . . . 70.340000000000003 110.845 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.75 -60.56 2.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 53.210000000000001 111.065 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.2 mt -52.86 -45.92 67.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 71.439999999999998 110.948 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 36.4 mtp180 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.46 . . . . 71.239999999999995 110.907 179.868 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.557 HD23 ' CE2' ' A' ' 13' ' ' PHE . 15.4 tp . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.792 0.33 . . . . 75.310000000000002 110.923 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -105.41 141.52 36.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 72.219999999999999 110.87 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.557 ' CE2' HD23 ' A' ' 11' ' ' LEU . 19.7 m-85 -139.36 170.18 16.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 75.420000000000002 110.921 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 mt -143.72 146.59 33.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.155 -0.475 . . . . 72.030000000000001 110.888 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 62.0 mtp85 . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 74.400000000000006 110.909 179.961 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.812 0.339 . . . . 75.219999999999999 110.909 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -129.69 158.81 38.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 75.420000000000002 110.873 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.479 HD11 ' CD2' ' A' ' 13' ' ' PHE . 11.2 tp -122.22 115.34 22.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.194 -0.457 . . . . 65.319999999999993 110.908 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.5 t -89.95 116.33 31.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 74.010000000000005 111.158 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.622 ' HE2' HG21 ' A' ' 65' ' ' VAL . 14.3 t60 -153.97 129.25 9.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 71.530000000000001 110.889 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 62.66 37.76 12.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 74.409999999999997 110.904 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m 60.19 26.1 15.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 51.140000000000001 110.901 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.468 ' CE1' ' CE1' ' A' ' 71' ' ' HIS . 13.4 m-85 -126.82 -176.82 3.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 75.329999999999998 110.859 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.421 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 14.7 mt -134.33 134.25 41.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 64.540000000000006 110.915 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.508 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.1 m-85 -129.16 169.16 15.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.249 -0.432 . . . . 74.540000000000006 110.99 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -129.32 138.01 51.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 74.409999999999997 110.869 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.478 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 38.3 tttt -61.88 113.33 2.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 73.349999999999994 110.911 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -88.62 -47.56 8.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 74.430000000000007 110.909 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -157.28 169.27 25.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 74.140000000000001 110.906 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.72 123.14 23.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 73.0 111.152 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.3 34.73 1.39 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.449 . . . . 71.349999999999994 111.12 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.64 -88.7 0.94 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.708 -0.758 . . . . 70.150000000000006 112.537 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -92.29 -0.22 57.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.891 0.377 . . . . 63.329999999999998 110.883 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -121.6 157.78 30.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 75.340000000000003 110.837 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.455 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 2.5 t -138.46 112.9 8.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.236 -0.438 . . . . 75.25 111.123 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -77.11 139.3 39.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.114 -0.493 . . . . 71.109999999999999 110.978 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.478 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 81.6 m95 -128.48 165.98 19.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.148 -0.478 . . . . 73.209999999999994 110.889 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -151.84 140.68 20.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 73.530000000000001 110.919 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.0 t -51.06 106.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 73.430000000000007 110.872 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.421 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.3 ptt-85 -40.17 -33.63 0.25 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 72.409999999999997 110.844 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.97 52.35 0.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 65.519999999999996 110.874 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -73.12 -50.83 20.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.232 -0.44 . . . . 71.519999999999996 110.886 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.19 -10.01 26.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 75.120000000000005 111.028 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.3 ttt180 -84.03 -60.34 2.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 74.519999999999996 110.847 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 52' ' ' CYS . 94.3 mt -106.78 25.62 11.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.187 -0.461 . . . . 75.420000000000002 110.956 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.73 23.25 0.18 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.754 -0.736 . . . . 73.219999999999999 112.528 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 50' ' ' LEU . 6.1 t -77.46 141.44 39.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.791 0.329 . . . . 72.019999999999996 110.861 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.13 22.32 9.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 74.439999999999998 110.861 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.521 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 47.8 t -66.42 135.45 54.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 74.349999999999994 110.843 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 -128.72 160.5 32.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.086 -0.506 . . . . 75.400000000000006 110.839 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -154.86 150.3 27.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 50.32 111.067 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 51.5 mt -120.38 131.61 72.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.446 . . . . 74.340000000000003 111.152 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.6 p -108.88 144.5 36.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 74.040000000000006 111.134 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -134.06 87.09 2.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.241 -0.436 . . . . 75.219999999999999 110.947 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.45 -87.07 1.55 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.753 -0.737 . . . . 74.25 112.413 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.496 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -126.25 -10.76 6.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.755 0.312 . . . . 70.340000000000003 110.871 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 51.8 mtm180 -92.4 -179.96 5.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.452 . . . . 74.420000000000002 110.951 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.522 HD11 ' CD2' ' A' ' 25' ' ' HIS . 19.8 tt -150.92 158.91 4.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 75.540000000000006 111.151 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 2.4 ttp -144.14 142.01 30.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 62.229999999999997 110.882 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.622 HG21 ' HE2' ' A' ' 25' ' ' HIS . 23.0 t -102.53 140.75 20.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 71.540000000000006 111.132 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 26.3 mmm -113.35 -64.12 1.35 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.506 . . . . 73.439999999999998 110.917 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -101.58 137.29 40.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 73.219999999999999 110.912 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 85.2 p -69.29 177.83 2.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 64.230000000000004 110.86 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.521 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 47.4 m-70 -111.52 145.74 38.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.102 -0.499 . . . . 72.319999999999993 110.886 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 8.6 t -97.44 13.78 28.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 70.120000000000005 110.955 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.468 ' CE1' ' CE1' ' A' ' 28' ' ' PHE . 28.3 p80 -140.67 178.87 7.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.497 . . . . 74.209999999999994 110.833 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -111.46 152.2 43.78 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.589 0.709 . . . . 74.329999999999998 110.878 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.459 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.77 157.31 60.8 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.654 2.236 . . . . 64.400000000000006 112.328 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -135.93 83.64 2.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 75.349999999999994 110.841 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 12.6 mt -47.42 -29.54 2.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.227 -0.442 . . . . 74.209999999999994 110.901 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.96 -51.15 50.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.49 . . . . 61.439999999999998 111.162 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.65 -41.77 98.94 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.747 -0.739 . . . . 41.25 112.457 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tp -68.56 -51.51 41.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.793 0.33 . . . . 74.299999999999997 110.924 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -50.61 -22.59 2.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.439999999999998 110.858 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.414 ' O ' ' C ' ' A' ' 81' ' ' LEU . . . -69.55 -67.81 0.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 74.420000000000002 111.06 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.414 ' C ' ' O ' ' A' ' 80' ' ' ALA . 6.6 mt -37.4 -52.31 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 73.010000000000005 110.904 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.453 . . . . 74.519999999999996 110.848 179.942 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.552 HD22 ' CZ ' ' A' ' 13' ' ' PHE . 27.9 tp . . . . . 0 CA--C 1.526 0.044 0 CA-C-O 120.741 0.305 . . . . 74.439999999999998 110.909 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -88.06 134.4 33.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 74.120000000000005 110.915 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.552 ' CZ ' HD22 ' A' ' 11' ' ' LEU . 64.2 m-85 -133.56 172.87 12.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.123 -0.49 . . . . 74.420000000000002 110.886 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.423 ' CD1' ' CG2' ' A' ' 24' ' ' VAL . 10.9 mt -146.82 150.26 34.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.158 -0.474 . . . . 72.129999999999995 110.891 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.466 . . . . 73.230000000000004 110.838 -179.996 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 tpp85 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.898 0.38 . . . . 73.129999999999995 110.83 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -117.01 158.19 24.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 75.510000000000005 110.943 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.471 HD11 ' CD1' ' A' ' 13' ' ' PHE . 13.7 tp -124.88 115.99 21.51 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 75.129999999999995 110.939 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.423 ' CG2' ' CD1' ' A' ' 14' ' ' LEU . 41.4 t -90.62 113.53 26.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 72.219999999999999 111.107 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.478 ' CG ' HD13 ' A' ' 63' ' ' ILE . 15.3 t60 -148.43 124.51 10.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 73.129999999999995 110.868 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 62.73 44.37 6.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 74.099999999999994 110.87 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.6 m 55.79 25.27 8.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 62.530000000000001 110.793 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -125.99 172.93 9.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 74.129999999999995 110.86 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 33.5 mt -125.94 134.45 51.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 64.209999999999994 110.92 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.49 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.6 m-85 -127.75 167.3 16.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 74.400000000000006 110.912 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -132.6 133.37 43.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 75.439999999999998 110.903 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.533 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 73.5 tttt -55.81 114.92 2.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.246 -0.434 . . . . 74.340000000000003 110.935 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -88.88 -57.22 2.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 73.329999999999998 110.842 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.508 ' HD2' ' CG ' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -151.45 -177.69 6.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 74.099999999999994 110.85 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -132.92 138.92 47.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.461 . . . . 74.450000000000003 111.124 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -110.72 35.98 3.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 61.310000000000002 111.107 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.1 -78.59 0.52 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.843 -0.694 . . . . 72.120000000000005 112.466 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -105.02 -20.4 13.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.91 0.386 . . . . 74.150000000000006 110.875 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -98.98 163.94 12.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.197 -0.456 . . . . 74.140000000000001 110.902 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.0 t -134.32 120.68 34.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 74.409999999999997 111.104 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.508 ' CG ' ' HD2' ' A' ' 34' ' ' LYS . 2.9 m-85 -79.34 142.26 36.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 75.530000000000001 110.878 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.533 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 80.6 m95 -134.93 150.69 50.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 72.530000000000001 110.905 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -133.06 138.03 46.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 73.530000000000001 110.876 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.403 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.9 t -51.3 104.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 62.539999999999999 110.895 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -40.47 -28.4 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 74.109999999999999 110.829 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 44' ' ' CYS . 2.9 m-20 -87.86 48.49 1.65 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.248 -0.433 . . . . 71.439999999999998 110.882 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -83.3 -40.45 19.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.198 -0.456 . . . . 75.319999999999993 110.892 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.37 -9.55 38.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 74.129999999999995 111.071 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -97.33 -55.26 2.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 73.510000000000005 110.838 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.436 ' O ' ' C ' ' A' ' 51' ' ' GLY . 28.4 mt -106.69 26.9 9.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 75.200000000000003 110.938 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . 0.436 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.62 56.13 0.78 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.677 -0.773 . . . . 71.329999999999998 112.529 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.6 t -126.47 118.34 24.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.835 0.35 . . . . 54.119999999999997 110.893 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.9 mmt-85 -93.44 2.74 56.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.205 -0.452 . . . . 74.420000000000002 110.874 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.468 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 37.8 t -40.82 105.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 72.109999999999999 110.871 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -102.93 -179.74 4.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 74.099999999999994 110.878 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.476 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -162.62 167.04 23.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 74.319999999999993 111.15 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 57.8 mt -131.52 123.89 53.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.287 -0.415 . . . . 73.200000000000003 111.11 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.446 HG22 ' NE1' ' A' ' 42' ' ' TRP . 31.3 p -108.92 141.19 41.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 75.310000000000002 111.133 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -147.24 111.54 5.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 71.409999999999997 110.886 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.73 -102.42 2.35 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.823 -0.704 . . . . 63.240000000000002 112.507 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.463 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.7 OUTLIER -129.0 10.35 5.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.786 0.327 . . . . 74.0 110.87 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -113.27 -174.99 2.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 74.420000000000002 110.893 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.478 HD13 ' CG ' ' A' ' 25' ' ' HIS . 18.5 tt -150.02 152.8 11.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 72.349999999999994 111.117 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.476 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 21.4 mtm -134.52 148.77 50.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 70.200000000000003 110.878 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.454 HG22 ' HE2' ' A' ' 25' ' ' HIS . 87.3 t -117.23 138.21 48.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 64.049999999999997 111.093 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 11.2 mtp -107.96 -54.69 2.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.485 . . . . 74.040000000000006 110.923 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.74 160.52 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 64.510000000000005 110.898 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 p -95.75 167.04 11.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 74.519999999999996 110.844 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . 0.468 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 38.0 m-70 -104.07 129.97 51.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 74.450000000000003 110.82 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.0 t -89.06 13.11 13.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.163 -0.471 . . . . 75.140000000000001 110.868 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . 0.424 ' CG ' HD12 ' A' ' 50' ' ' LEU . 19.1 p80 -133.34 172.79 12.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 75.430000000000007 110.837 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -104.65 151.41 39.27 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.711 . . . . 75.340000000000003 110.926 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 151.6 69.06 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.666 2.244 . . . . 73.239999999999995 112.303 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -112.7 81.76 1.54 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.189 -0.46 . . . . 54.109999999999999 110.834 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.9 mt -51.33 -17.69 0.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 73.519999999999996 110.857 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.86 -55.1 3.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 73.019999999999996 111.12 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.99 -37.52 91.59 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.717 -0.754 . . . . 65.549999999999997 112.526 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 12.6 tp -68.87 -51.01 44.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.779 0.323 . . . . 73.409999999999997 110.946 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -53.34 -30.93 41.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 75.200000000000003 110.87 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.05 -28.54 66.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 73.049999999999997 111.09 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mt -79.2 -39.02 34.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 74.030000000000001 110.885 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.417 ' CB ' ' CZ ' ' A' ' 82' ' ' ARG . 4.0 mtp-105 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 72.510000000000005 110.847 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.471 ' H ' ' CE1' ' A' ' 61' ' ' HIS . 11.8 tp . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.823 0.344 . . . . 75.430000000000007 110.872 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' A' ' 13' ' ' PHE . 8.1 tp10 -103.56 146.57 28.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 74.230000000000004 110.958 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.413 ' N ' ' HG3' ' A' ' 12' ' ' GLU . 25.7 m-85 -139.44 172.93 12.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 74.230000000000004 110.84 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.433 HD11 ' CG2' ' A' ' 24' ' ' VAL . 8.9 mt -142.06 157.68 44.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 73.040000000000006 110.905 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.43 ' N ' ' HD2' ' A' ' 15' ' ' ARG . 2.5 mpt_? . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 73.099999999999994 110.849 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.817 0.341 . . . . 71.239999999999995 110.892 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -112.55 159.75 18.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.29 -0.414 . . . . 74.129999999999995 110.927 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.7 tp -131.96 130.72 41.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 73.299999999999997 110.953 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.433 ' CG2' HD11 ' A' ' 14' ' ' LEU . 97.7 t -97.1 111.43 27.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 60.020000000000003 111.137 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.546 ' CD2' ' CD1' ' A' ' 63' ' ' ILE . 2.3 t60 -148.05 129.55 14.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.429 . . . . 75.299999999999997 110.855 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 59.88 38.59 21.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 73.140000000000001 110.892 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 m 61.22 18.29 9.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.484 . . . . 73.310000000000002 110.863 -179.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -116.71 179.53 3.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 70.209999999999994 110.85 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 27.9 mt -130.37 135.4 48.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 74.140000000000001 110.886 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' TYR . . . . . 0.499 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.2 m-85 -128.37 163.01 25.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.278 -0.419 . . . . 74.25 110.911 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.4 mtt180 -117.48 126.55 52.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 75.540000000000006 110.808 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.509 ' HB2' ' CZ3' ' A' ' 42' ' ' TRP . 54.2 tttt -54.55 110.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 74.450000000000003 110.882 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.429 ' C ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -81.38 -58.63 2.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 74.140000000000001 110.934 179.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.83 -177.57 5.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 75.150000000000006 110.884 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -141.03 109.31 5.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 65.420000000000002 111.13 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.61 90.31 7.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 71.329999999999998 111.083 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 58.35 -92.89 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.737 -0.744 . . . . 74.430000000000007 112.505 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.446 ' CD ' ' N ' ' A' ' 38' ' ' GLU . 9.1 mp0 -106.99 9.97 30.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 74.109999999999999 110.871 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.5 mtmt -116.48 155.76 28.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 72.109999999999999 110.96 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 15.4 t -134.51 122.6 40.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.313 -0.403 . . . . 74.129999999999995 111.139 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -87.18 141.8 28.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.465 . . . . 70.540000000000006 110.851 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' TRP . . . . . 0.509 ' CZ3' ' HB2' ' A' ' 32' ' ' LYS . 67.5 m95 -135.29 163.38 30.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.082 -0.508 . . . . 75.299999999999997 110.94 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 12.3 ptt? -150.17 140.36 22.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.3 -0.409 . . . . 74.319999999999993 110.919 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -52.85 107.58 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 73.120000000000005 110.889 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.1 ptt-85 -40.23 -31.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 75.219999999999999 110.947 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -81.96 43.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 75.409999999999997 110.888 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -85.33 -34.93 21.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.209 -0.45 . . . . 72.25 110.866 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -96.24 -14.97 22.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 63.420000000000002 111.035 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -97.04 -58.72 1.95 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.271 -0.422 . . . . 73.109999999999999 110.901 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.0 mt -99.49 21.9 11.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 75.209999999999994 110.926 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.56 37.82 1.97 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.764 -0.732 . . . . 73.310000000000002 112.43 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 30.9 t -93.87 110.42 22.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.82 0.343 . . . . 70.230000000000004 110.838 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.414 ' O ' ' CD ' ' A' ' 55' ' ' ARG . 0.9 OUTLIER -91.94 19.38 6.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 74.010000000000005 110.893 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.5 t -63.09 108.49 1.25 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 73.510000000000005 110.92 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.414 ' CD ' ' O ' ' A' ' 53' ' ' ARG . 1.1 mpt_? -107.06 156.4 18.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 75.450000000000003 110.888 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.8 167.68 21.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 111.117 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.452 ' CD1' ' HE2' ' A' ' 64' ' ' MET . 55.2 mt -141.57 123.42 13.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.192 -0.458 . . . . 71.0 111.104 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.452 HG22 ' NE1' ' A' ' 42' ' ' TRP . 18.4 p -109.33 149.94 28.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.113 -0.494 . . . . 71.439999999999998 111.149 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.47 89.06 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 72.5 110.867 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 86.61 -87.56 1.56 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.733 -0.746 . . . . 73.450000000000003 112.477 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' HIS . . . . . 0.471 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER -126.5 -8.19 6.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.817 0.341 . . . . 72.109999999999999 110.898 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -91.4 -177.4 4.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 73.140000000000001 110.855 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.546 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 5.9 tt -150.49 153.8 9.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 74.430000000000007 111.122 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' MET . . . . . 0.452 ' HE2' ' CD1' ' A' ' 57' ' ' ILE . 3.6 tmm? -138.87 151.52 47.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 75.200000000000003 110.85 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.516 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 77.7 t -111.58 134.07 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 75.230000000000004 111.173 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 13.0 mtm -103.26 -36.03 8.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 74.319999999999993 110.871 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -140.05 160.18 40.51 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.245 -0.434 . . . . 75.150000000000006 110.899 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.2 m -86.11 -179.52 6.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.186 -0.461 . . . . 74.010000000000005 110.826 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 70.6 m-70 -113.15 137.44 51.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 71.420000000000002 110.844 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.8 t -94.24 14.27 20.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 74.329999999999998 110.883 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -140.69 173.6 11.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 71.430000000000007 110.822 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -106.34 152.29 40.5 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.589 0.709 . . . . 62.039999999999999 110.832 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 167.02 25.71 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.719 2.279 . . . . 74.450000000000003 112.358 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -144.35 82.93 1.71 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.28 -0.418 . . . . 72.430000000000007 110.866 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.1 mt -47.03 -25.47 0.83 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 75.230000000000004 110.895 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.25 -42.52 83.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.049999999999997 111.102 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.61 -38.31 21.0 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.777 -0.725 . . . . 72.120000000000005 112.468 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tp -67.64 -41.45 83.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.75 0.309 . . . . 74.25 110.915 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -63.81 -25.56 68.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.192 -0.458 . . . . 75.200000000000003 110.906 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.39 -51.6 59.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 61.210000000000001 111.138 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.18 -30.78 71.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 74.329999999999998 110.869 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mtp-105 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.446 . . . . 62.240000000000002 110.92 179.939 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.39 0 N-CA-C 112.515 -0.234 . . . . 70.530000000000001 112.515 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.1 m -128.95 110.05 11.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.847 0.356 . . . . 75.219999999999999 110.882 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 m -134.14 131.17 38.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.129 -0.487 . . . . 74.25 110.855 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.38 164.87 29.36 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.724 -0.751 . . . . 74.530000000000001 112.533 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.1 t -124.49 112.59 17.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.901 0.382 . . . . 54.539999999999999 110.888 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 81.0 p -153.7 145.19 23.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 74.140000000000001 110.842 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -56.6 -61.42 7.5 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.756 -0.735 . . . . 73.430000000000007 112.435 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.46 HD12 ' CG ' ' A' ' 62' ' ' ARG . 14.7 tp -87.75 98.15 11.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.753 0.311 . . . . 75.530000000000001 110.857 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -86.76 145.96 40.12 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.635 0.731 . . . . 73.129999999999995 110.826 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.42 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 53.0 Cg_endo -69.85 -172.33 0.57 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.721 2.281 . . . . 70.420000000000002 112.33 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.48 ' H ' ' CE1' ' A' ' 61' ' ' HIS . 16.4 tp -154.83 146.45 23.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 74.200000000000003 110.888 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -106.19 150.24 26.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 61.130000000000003 110.875 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -137.81 172.47 12.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 71.409999999999997 110.807 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.452 HD13 ' CG2' ' A' ' 24' ' ' VAL . 8.5 mt -142.11 157.53 44.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.065 -0.516 . . . . 74.140000000000001 110.883 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -127.97 124.52 37.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 70.409999999999997 110.875 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.07 165.52 14.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 74.030000000000001 111.126 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.45 ' O ' ' C ' ' A' ' 18' ' ' LEU . 6.3 m -54.13 -174.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 74.439999999999998 110.851 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.45 ' C ' ' O ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -34.56 101.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.105 -0.498 . . . . 72.400000000000006 110.885 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.03 -22.34 0.11 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.722 -0.751 . . . . 52.509999999999998 112.482 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 115.72 -166.68 12.28 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.764 -0.731 . . . . 74.219999999999999 112.454 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.11 150.53 27.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.836 0.351 . . . . 63.240000000000002 110.904 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -99.49 167.88 10.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 73.129999999999995 110.927 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tp -129.43 125.98 37.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 73.040000000000006 110.951 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.452 ' CG2' HD13 ' A' ' 14' ' ' LEU . 77.6 t -95.38 116.57 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 71.209999999999994 111.119 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.534 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 9.0 t60 -154.77 126.08 7.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 73.150000000000006 110.902 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 63.89 38.51 8.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 73.420000000000002 110.847 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.1 m 58.55 24.61 12.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 71.239999999999995 110.858 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -121.52 -177.3 3.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.115 -0.493 . . . . 74.409999999999997 110.887 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.401 HD23 ' CD1' ' A' ' 78' ' ' LEU . 69.8 mt -132.76 132.98 42.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.093 -0.503 . . . . 64.109999999999999 110.935 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.499 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -127.63 170.07 13.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.175 -0.466 . . . . 74.120000000000005 110.888 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.446 ' NE ' ' HB2' ' A' ' 45' ' ' ARG . 20.3 mtt180 -131.18 137.09 48.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 71.430000000000007 110.83 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.45 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 37.6 tttt -64.42 110.52 2.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 73.439999999999998 110.9 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -82.66 -59.25 2.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 74.519999999999996 110.888 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.482 ' HE2' ' CD2' ' A' ' 41' ' ' TYR . 10.1 pttm -142.81 177.87 8.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 74.239999999999995 110.852 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -142.79 120.8 12.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.245 -0.434 . . . . 73.329999999999998 111.098 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.85 32.68 0.8 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 74.120000000000005 111.1 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.07 -60.31 4.91 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.753 -0.737 . . . . 73.040000000000006 112.508 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -105.79 -13.04 15.66 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.864 0.364 . . . . 74.230000000000004 110.859 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.437 ' HG2' ' CG ' ' A' ' 59' ' ' GLN . 36.2 mtmt -121.24 148.36 44.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.158 -0.474 . . . . 74.329999999999998 110.877 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.41 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 3.5 t -125.76 111.12 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 72.400000000000006 111.152 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.482 ' CD2' ' HE2' ' A' ' 34' ' ' LYS . 3.6 m-85 -79.72 141.77 36.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 73.219999999999999 110.928 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.45 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 63.6 m95 -130.29 166.28 20.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.033 -0.53 . . . . 75.409999999999997 110.938 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.0 ptt? -146.75 135.49 22.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 70.340000000000003 110.879 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.9 t -50.16 109.6 0.31 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 63.43 110.869 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.446 ' HB2' ' NE ' ' A' ' 31' ' ' ARG . 39.1 ptt85 -44.48 -23.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 74.430000000000007 110.923 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.47 30.86 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 61.329999999999998 110.856 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -82.01 -26.11 34.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 75.019999999999996 110.913 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.04 -23.56 16.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 71.310000000000002 111.17 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.0 tpp85 -96.7 -60.56 1.58 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.477 . . . . 73.319999999999993 110.86 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 mt -94.34 22.79 5.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 74.409999999999997 110.889 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 38.08 41.88 1.08 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.742 -0.742 . . . . 63.210000000000001 112.486 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.2 t -90.26 120.76 31.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.907 0.384 . . . . 70.099999999999994 110.814 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -99.3 13.33 33.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 73.299999999999997 110.862 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.7 t -65.03 117.74 8.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 64.239999999999995 110.874 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -114.87 159.4 20.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 75.219999999999999 110.917 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.462 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -144.74 164.45 30.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 71.319999999999993 111.097 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 64' ' ' MET . 69.1 mt -127.25 129.23 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.319999999999993 111.124 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.418 HG23 ' CD1' ' A' ' 42' ' ' TRP . 42.2 p -110.36 136.84 48.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 73.040000000000006 111.156 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.437 ' CG ' ' HG2' ' A' ' 39' ' ' LYS . 4.7 mt-30 -144.48 116.23 8.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 74.120000000000005 110.945 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 70.19 -99.2 0.69 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.71 -0.757 . . . . 64.200000000000003 112.535 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.48 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -128.26 4.84 5.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.763 0.316 . . . . 75.010000000000005 110.803 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.46 ' CG ' HD12 ' A' ' 8' ' ' LEU . 42.5 mtm180 -107.01 -175.22 2.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.209999999999994 110.817 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.47 HD13 ' CD2' ' A' ' 25' ' ' HIS . 21.3 tt -150.81 162.75 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 73.340000000000003 111.074 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.462 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 3.9 mpp? -141.6 147.66 37.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.108 -0.496 . . . . 74.409999999999997 110.864 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.534 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 43.7 t -116.76 130.13 72.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 74.049999999999997 111.121 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 19.4 mtp -89.42 -64.08 1.19 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.211 -0.449 . . . . 74.129999999999995 110.852 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.9 ttm180 -112.34 175.93 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.268 -0.424 . . . . 74.129999999999995 110.901 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.4 p -90.99 -176.18 4.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 75.319999999999993 110.909 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -114.17 137.71 51.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 74.040000000000006 110.889 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.3 t -93.27 13.88 19.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.234 -0.439 . . . . 71.420000000000002 110.839 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 26.7 p80 -141.48 169.29 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 74.310000000000002 110.866 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.441 ' N ' ' CD ' ' A' ' 72' ' ' GLN . 1.8 mp0 -102.57 151.79 38.29 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.576 0.703 . . . . 73.0 110.92 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.88 149.6 66.32 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.639 2.226 . . . . 63.329999999999998 112.347 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -124.76 81.14 1.92 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 75.540000000000006 110.816 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.5 mt -48.75 -22.9 0.88 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 75.200000000000003 110.919 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -75.24 -41.33 57.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.400000000000006 111.103 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -80.68 -31.38 36.59 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.724 -0.75 . . . . 71.420000000000002 112.486 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.401 ' CD1' HD23 ' A' ' 29' ' ' LEU . 9.6 tp -68.72 -38.31 80.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.707 0.289 . . . . 73.329999999999998 110.891 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -70.3 -34.72 73.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.187 -0.46 . . . . 75.329999999999998 110.896 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.93 -20.09 66.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 73.420000000000002 111.062 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.0 mt -90.15 -21.92 21.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 73.540000000000006 110.888 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 28.9 mtt180 -82.96 -28.66 29.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 74.340000000000003 110.877 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.423 ' CG ' ' N ' ' A' ' 84' ' ' ARG . 0.9 OUTLIER -60.7 -43.28 97.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 75.439999999999998 110.952 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.423 ' N ' ' CG ' ' A' ' 83' ' ' GLN . 1.7 ptm180 -71.64 -5.61 34.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.118 -0.492 . . . . 73.549999999999997 110.823 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -100.79 -40.35 7.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 72.230000000000004 110.872 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.404 ' C ' HD11 ' A' ' 87' ' ' LEU . 23.1 mtp180 -82.8 14.78 3.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.173 -0.467 . . . . 70.319999999999993 110.852 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.404 HD11 ' C ' ' A' ' 86' ' ' ARG . 6.8 mp . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 74.140000000000001 110.894 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.448 -0.261 . . . . 61.439999999999998 112.448 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.2 p -49.12 144.85 4.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.856 0.36 . . . . 71.230000000000004 110.872 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.8 t -133.97 82.71 1.99 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 60.109999999999999 110.848 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -161.35 42.04 0.4 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.803 -0.713 . . . . 74.400000000000006 112.526 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.8 p -89.75 122.05 32.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.857 0.361 . . . . 63.140000000000001 110.882 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.8 m -121.93 138.67 54.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 75.109999999999999 110.858 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.83 -4.07 7.46 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.726 -0.749 . . . . 71.0 112.5 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.464 ' HB2' ' CG ' ' A' ' 62' ' ' ARG . 1.3 pt? -175.11 141.4 0.57 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.768 0.318 . . . . 74.329999999999998 110.894 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.456 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -75.1 144.14 78.53 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.681 0.753 . . . . 73.310000000000002 110.855 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.565 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 53.9 Cg_endo -69.73 -165.2 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.69 2.26 . . . . 73.049999999999997 112.367 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.554 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 14.5 tp -151.88 145.23 24.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.207 -0.452 . . . . 74.239999999999995 110.931 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.449 ' C ' ' CD1' ' A' ' 13' ' ' PHE . 34.0 tt0 -113.52 145.73 40.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 72.510000000000005 110.911 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.554 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 0.8 OUTLIER -140.0 167.9 21.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 75.400000000000006 110.898 -179.925 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.415 ' CD2' ' HG2' ' A' ' 82' ' ' ARG . 8.9 mt -137.57 117.53 13.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 74.140000000000001 111.012 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -73.11 135.71 44.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 72.209999999999994 110.903 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.548 HG22 ' CD2' ' A' ' 22' ' ' PHE . 1.8 p -115.99 150.82 36.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 74.230000000000004 111.152 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 p -80.58 123.76 28.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 63.409999999999997 110.877 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.9 mt 41.25 28.17 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 73.450000000000003 110.97 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.49 -25.4 2.19 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.771 -0.728 . . . . 71.120000000000005 112.488 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 120.71 -143.2 16.24 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.679 -0.772 . . . . 54.119999999999997 112.493 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -129.04 144.79 51.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.811 0.339 . . . . 73.310000000000002 110.833 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.548 ' CD2' HG22 ' A' ' 16' ' ' THR . 3.9 m-85 -110.95 164.27 12.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 73.010000000000005 110.909 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.4 tp -129.16 113.68 15.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 74.540000000000006 110.962 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -88.01 112.08 23.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 74.530000000000001 111.11 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.575 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 9.2 t60 -149.27 125.49 10.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.151 -0.477 . . . . 72.439999999999998 110.821 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 63.21 42.96 6.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.24 -0.436 . . . . 75.409999999999997 110.904 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.7 m 56.05 19.94 4.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 65.120000000000005 110.902 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -116.83 -175.42 2.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.016 -0.538 . . . . 74.040000000000006 110.915 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.5 mt -136.61 133.6 36.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.161 -0.472 . . . . 71.340000000000003 110.922 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.515 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -129.23 163.06 26.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 74.239999999999995 110.914 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.8 mtp180 -124.77 139.88 53.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 71.200000000000003 110.928 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.8 tttt -60.91 116.18 4.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 74.319999999999993 110.898 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -91.97 -57.57 2.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 75.209999999999994 110.904 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.7 pttt -151.32 168.48 24.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 73.25 110.924 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -132.7 119.19 20.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 73.530000000000001 111.09 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -82.54 38.01 0.54 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 74.340000000000003 111.067 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.21 -50.59 4.0 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.755 -0.736 . . . . 74.420000000000002 112.5 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -114.44 -27.81 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.908 0.385 . . . . 54.520000000000003 110.878 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -104.61 154.81 19.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 74.319999999999993 110.883 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 t -127.87 111.97 26.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.275 -0.421 . . . . 74.230000000000004 111.102 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.463 ' CZ ' HD13 ' A' ' 57' ' ' ILE . 3.4 m-85 -79.45 145.27 33.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 64.319999999999993 110.893 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.434 ' N ' ' O ' ' A' ' 56' ' ' ALA . 66.5 m95 -135.3 163.14 30.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.117 -0.492 . . . . 73.140000000000001 110.875 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.9 ptt? -145.79 132.06 19.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 71.019999999999996 110.909 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.406 ' C ' ' N ' ' A' ' 46' ' ' ASP . 1.8 t -46.1 108.46 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 75.329999999999998 110.813 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -43.49 -23.65 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 70.349999999999994 110.858 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.406 ' N ' ' C ' ' A' ' 44' ' ' CYS . 3.3 m-20 -81.39 42.06 0.65 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 71.349999999999994 110.822 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -85.8 -36.09 20.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 75.25 110.934 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.89 -14.57 20.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 75.230000000000004 111.128 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -98.91 -53.71 3.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 71.200000000000003 110.914 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.447 ' O ' ' C ' ' A' ' 51' ' ' GLY . 33.9 mt -108.01 27.34 9.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.201 -0.454 . . . . 74.319999999999993 110.903 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.447 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.63 47.08 0.61 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.761 -0.733 . . . . 70.409999999999997 112.484 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.3 t -97.59 142.71 29.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.759 0.314 . . . . 54.020000000000003 110.895 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.422 ' HD2' ' N ' ' A' ' 53' ' ' ARG . 0.4 OUTLIER -118.37 -0.87 11.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.172 -0.467 . . . . 74.140000000000001 110.926 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.555 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . 1.1 t -52.43 116.13 2.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.205 -0.452 . . . . 64.030000000000001 110.862 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.6 mtm105 -111.14 171.16 7.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 75.209999999999994 110.819 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.476 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -160.68 151.32 18.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 74.420000000000002 111.092 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.492 ' O ' ' N ' ' A' ' 64' ' ' MET . 23.0 mt -115.49 130.16 70.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 74.219999999999999 111.099 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.3 p -111.32 141.47 44.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 72.439999999999998 111.156 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -146.72 109.3 4.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 75.25 110.9 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 75.29 -95.95 0.98 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.718 -0.753 . . . . 72.420000000000002 112.448 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.565 ' CD2' ' HA ' ' A' ' 10' ' ' PRO . 1.4 t60 -129.03 1.18 5.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.804 0.335 . . . . 73.420000000000002 110.818 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.464 ' CG ' ' HB2' ' A' ' 8' ' ' LEU . 19.7 mmm-85 -102.79 -176.41 3.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 74.129999999999995 110.894 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.534 HD11 ' CD2' ' A' ' 25' ' ' HIS . 20.4 tt -150.4 161.97 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.199 -0.455 . . . . 74.310000000000002 111.158 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.492 ' N ' ' O ' ' A' ' 57' ' ' ILE . 16.8 ttm -138.62 141.28 39.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 74.409999999999997 110.933 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.575 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 55.2 t -106.41 133.25 51.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 73.140000000000001 111.129 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 23.5 mmt -93.87 -65.1 1.01 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 74.120000000000005 110.956 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -119.5 -178.27 3.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 63.530000000000001 110.903 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 77.3 p -91.82 -175.36 4.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 73.019999999999996 110.895 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.555 ' CE1' ' HB3' ' A' ' 54' ' ' SER . 75.8 m-70 -117.84 144.09 45.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 64.200000000000003 110.896 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 90.0 m -97.07 11.2 37.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 72.030000000000001 110.873 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.434 ' CG ' HD12 ' A' ' 50' ' ' LEU . 28.6 p80 -139.08 166.28 24.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 72.310000000000002 110.873 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -97.7 152.29 38.06 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.569 0.699 . . . . 75.140000000000001 110.953 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.71 160.31 50.2 Favored 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 122.755 2.303 . . . . 74.400000000000006 112.264 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.24 93.48 2.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.115 -0.493 . . . . 75.519999999999996 110.841 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.497 ' CD2' ' N ' ' A' ' 75' ' ' LEU . 0.5 OUTLIER -60.99 -22.18 64.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 74.239999999999995 110.93 -179.93 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.2 -55.38 9.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 75.420000000000002 111.124 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.22 -29.1 74.29 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.687 -0.768 . . . . 73.230000000000004 112.536 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 10.9 tp -77.33 -48.59 16.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.788 0.327 . . . . 73.439999999999998 110.896 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -64.19 -25.0 67.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 74.420000000000002 110.849 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.44 -25.73 63.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 74.420000000000002 111.121 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mt -79.12 -49.63 12.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.166 -0.47 . . . . 65.340000000000003 110.915 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 85' ' ' GLU . 19.8 mtm180 -55.07 -53.62 53.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.481 . . . . 73.439999999999998 110.907 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -40.42 -40.3 1.17 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 73.129999999999995 110.913 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -62.81 -40.8 98.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 74.040000000000006 110.881 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.436 ' N ' ' O ' ' A' ' 82' ' ' ARG . 25.6 mm-40 -78.83 -56.88 4.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.185 -0.461 . . . . 72.120000000000005 110.869 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.422 ' O ' ' NE ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -133.78 163.74 28.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 72.209999999999994 110.816 -179.885 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.8 mt . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.48 . . . . 74.030000000000001 110.964 -179.965 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 N-CA-C 112.494 -0.242 . . . . 52.119999999999997 112.494 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.2 p -90.65 36.24 0.89 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.933 0.397 . . . . 53.229999999999997 110.88 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.8 p -112.75 132.7 55.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 72.430000000000007 110.916 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -165.63 -105.03 0.18 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.712 -0.756 . . . . 63.109999999999999 112.474 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.4 t 69.13 26.16 5.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.835 0.35 . . . . 53.25 110.819 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.4 t -85.4 80.0 9.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 71.120000000000005 110.919 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.03 -107.61 3.53 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.706 -0.759 . . . . 71.109999999999999 112.465 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.441 ' HB2' ' CG ' ' A' ' 62' ' ' ARG . 1.4 pt? -62.79 139.48 58.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.805 0.336 . . . . 75.439999999999998 110.916 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -70.03 144.01 92.31 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.6 0.715 . . . . 72.340000000000003 110.881 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.556 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 53.5 Cg_endo -69.8 -163.83 0.12 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.649 2.233 . . . . 71.329999999999998 112.383 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.528 HD21 ' CZ ' ' A' ' 13' ' ' PHE . 15.8 tp -159.82 143.31 14.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.243 -0.435 . . . . 73.409999999999997 110.875 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -106.42 151.04 25.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 75.510000000000005 110.85 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.528 ' CZ ' HD21 ' A' ' 11' ' ' LEU . 48.9 m-85 -139.98 170.52 15.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 75.450000000000003 110.866 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.5 mt -143.89 162.25 36.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 72.140000000000001 110.936 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.7 mtt85 -127.23 136.51 52.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 75.349999999999994 110.896 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.42 HG21 ' CE2' ' A' ' 22' ' ' PHE . 3.2 p -100.97 142.87 31.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 72.319999999999993 111.18 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -39.07 -49.65 1.78 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 64.510000000000005 110.93 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.1 mt -79.78 172.88 13.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.117 -0.492 . . . . 75.299999999999997 110.944 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.97 78.77 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.648 -0.787 . . . . 71.439999999999998 112.5 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -165.27 136.87 4.39 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.772 -0.727 . . . . 71.239999999999995 112.501 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -111.33 151.18 28.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 73.519999999999996 110.899 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.42 ' CE2' HG21 ' A' ' 16' ' ' THR . 3.4 m-85 -116.04 165.29 13.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 75.239999999999995 110.904 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.6 tp -131.71 117.59 18.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 75.299999999999997 110.86 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.5 t -93.55 111.7 25.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.453 . . . . 75.540000000000006 111.101 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.548 ' CD2' HD13 ' A' ' 63' ' ' ILE . 57.5 t60 -147.98 132.61 17.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 74.049999999999997 110.832 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.415 ' HG3' ' NE2' ' A' ' 25' ' ' HIS . 23.6 mt-10 59.6 35.58 22.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 74.230000000000004 110.892 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m 63.43 29.32 15.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 75.040000000000006 110.909 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.542 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 22.1 m-85 -130.72 -178.17 4.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 70.340000000000003 110.91 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 16.2 mt -133.38 133.15 42.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 72.5 110.913 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.495 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.2 m-85 -125.71 161.51 27.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 60.229999999999997 110.919 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.476 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 3.3 mtt-85 -115.63 126.35 54.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 72.400000000000006 110.822 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.513 ' HB2' ' CH2' ' A' ' 42' ' ' TRP . 15.6 ttpt -57.45 110.07 0.8 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.451 . . . . 73.409999999999997 110.86 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -82.38 -58.14 3.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 74.430000000000007 110.891 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.1 pttp -149.88 -176.66 5.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 64.439999999999998 110.88 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.58 117.17 7.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 65.519999999999996 111.173 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.34 80.23 4.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 73.450000000000003 111.098 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.68 -78.14 0.37 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.717 -0.754 . . . . 64.409999999999997 112.503 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -116.19 -13.8 11.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.963 0.411 . . . . 74.430000000000007 110.938 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -94.08 149.64 21.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.114 -0.494 . . . . 75.430000000000007 110.937 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 1.7 t -132.55 118.99 37.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 75.239999999999995 111.126 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -87.49 134.22 33.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 74.450000000000003 110.898 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.513 ' CH2' ' HB2' ' A' ' 32' ' ' LYS . 68.5 m95 -124.32 168.17 13.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 75.310000000000002 110.893 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -152.86 133.54 13.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.246 -0.434 . . . . 75.540000000000006 110.866 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -42.89 111.02 0.22 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.43 . . . . 73.310000000000002 110.888 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.476 ' HB2' ' CZ ' ' A' ' 31' ' ' ARG . 37.0 ptt85 -52.36 -19.32 2.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 75.150000000000006 110.844 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.16 10.81 3.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.181 -0.463 . . . . 75.129999999999995 110.895 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 2.4 pp0? -68.75 -8.41 42.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 71.25 110.88 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.81 -43.95 7.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 72.319999999999993 111.067 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -93.38 -47.83 6.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 63.109999999999999 110.848 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.432 HD12 ' CD2' ' A' ' 71' ' ' HIS . 29.5 mt -88.93 -12.48 41.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 74.310000000000002 110.922 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 70.59 -0.51 26.51 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.789 -0.72 . . . . 71.430000000000007 112.484 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.403 ' O ' ' CB ' ' A' ' 47' ' ' GLN . 32.9 t -47.2 144.76 2.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.824 0.345 . . . . 60.340000000000003 110.884 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -125.07 19.29 8.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 72.439999999999998 110.895 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.419 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . 32.3 t -66.86 111.64 3.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 75.109999999999999 110.862 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -109.98 145.19 37.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 74.439999999999998 110.934 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.449 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -137.37 154.93 49.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.22 -0.445 . . . . 64.239999999999995 111.029 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.437 ' O ' ' N ' ' A' ' 64' ' ' MET . 75.7 mt -111.33 135.12 51.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 74.5 111.103 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.6 p -117.84 128.76 55.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 64.450000000000003 111.18 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -131.81 95.1 3.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 75.209999999999994 110.85 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 87.4 -95.44 2.08 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.74 -0.743 . . . . 65.340000000000003 112.502 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.556 ' CD2' ' HA ' ' A' ' 10' ' ' PRO . 1.4 t60 -127.09 0.23 6.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.797 0.332 . . . . 72.310000000000002 110.882 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.441 ' CG ' ' HB2' ' A' ' 8' ' ' LEU . 15.3 mmm-85 -104.18 -179.26 3.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 74.310000000000002 110.814 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.548 HD13 ' CD2' ' A' ' 25' ' ' HIS . 17.6 tt -150.3 160.57 4.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 75.340000000000003 111.147 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.449 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 4.5 mpp? -137.65 140.99 41.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 71.450000000000003 110.896 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 92.6 t -102.7 127.9 56.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 73.140000000000001 111.113 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.7 mtm -105.16 -16.59 14.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 110.865 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -154.49 160.28 41.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 75.409999999999997 110.851 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 88.2 p -90.09 179.25 5.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 62.439999999999998 110.831 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.486 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 38.4 m-70 -116.5 134.28 55.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.089 -0.505 . . . . 73.109999999999999 110.881 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 45.4 t -85.85 4.94 34.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 64.040000000000006 110.854 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.432 ' CD2' HD12 ' A' ' 50' ' ' LEU . 28.2 p80 -131.6 163.97 26.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.454 . . . . 74.430000000000007 110.869 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -100.82 149.21 35.99 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.617 0.722 . . . . 74.239999999999995 110.898 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.542 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 54.3 Cg_endo -69.71 156.47 63.39 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.692 2.261 . . . . 62.340000000000003 112.395 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.93 95.69 3.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.233 -0.439 . . . . 71.400000000000006 110.885 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mt -57.06 -14.82 4.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 64.319999999999993 110.924 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -74.47 -46.26 40.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.249 -0.432 . . . . 72.120000000000005 111.148 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.67 -31.57 40.11 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.686 -0.768 . . . . 62.420000000000002 112.508 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -70.66 -42.49 70.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.786 0.327 . . . . 64.510000000000005 110.964 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -64.56 -35.76 82.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 71.519999999999996 110.934 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.37 -37.98 79.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 72.150000000000006 111.083 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.3 mt -69.94 -22.58 63.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.272 -0.422 . . . . 75.329999999999998 110.916 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 35.7 mtt180 -89.02 -25.26 22.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 72.239999999999995 110.891 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -77.02 -27.11 54.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 73.120000000000005 110.954 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -73.48 -25.76 60.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 75.530000000000001 110.838 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.52 -50.36 12.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.479 . . . . 75.450000000000003 110.936 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.85 175.88 8.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.129 -0.487 . . . . 75.409999999999997 110.896 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.9 tt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 72.400000000000006 110.932 179.998 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.471 -0.252 . . . . 75.439999999999998 112.471 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.6 t -123.75 75.34 1.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.869 0.366 . . . . 73.400000000000006 110.875 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.2 m -99.04 -55.31 2.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 74.409999999999997 110.896 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 59.15 -103.57 0.41 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.707 -0.759 . . . . 73.120000000000005 112.525 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 43.3 t -87.01 138.97 31.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.85 0.357 . . . . 72.239999999999995 110.801 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.2 m -77.19 167.22 22.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 73.409999999999997 110.846 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 112.04 22.17 6.03 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.701 -0.761 . . . . 54.140000000000001 112.482 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.0 tp -77.96 99.52 6.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.801 0.334 . . . . 74.219999999999999 110.948 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -78.4 146.71 70.74 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.619 0.723 . . . . 74.120000000000005 110.868 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 -169.02 0.3 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.678 2.252 . . . . 62.009999999999998 112.312 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.434 HD22 ' CZ ' ' A' ' 13' ' ' PHE . 11.1 tp -157.89 148.33 20.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.439999999999998 110.892 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.406 ' CD ' ' NH1' ' A' ' 82' ' ' ARG . 24.8 tt0 -104.51 144.45 31.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 74.319999999999993 110.916 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.488 ' CE2' HD13 ' A' ' 23' ' ' LEU . 20.4 m-85 -140.03 171.92 13.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 65.219999999999999 110.85 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.42 HD12 ' CG2' ' A' ' 24' ' ' VAL . 6.2 mt -144.21 155.82 44.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 73.140000000000001 110.973 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -116.8 141.38 48.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 73.420000000000002 110.822 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.0 p -112.6 173.17 6.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 72.329999999999998 111.149 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.8 p -108.76 -36.18 6.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.445 . . . . 65.319999999999993 110.851 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.7 mt -91.85 -47.61 7.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.12 -0.491 . . . . 73.540000000000006 110.908 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -82.85 -112.42 0.49 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.719 -0.753 . . . . 73.0 112.486 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.24 -103.89 0.3 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.746 -0.74 . . . . 71.5 112.497 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -121.81 156.75 32.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.91 0.386 . . . . 74.519999999999996 110.822 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -129.26 158.6 38.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 75.319999999999993 110.868 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.488 HD13 ' CE2' ' A' ' 13' ' ' PHE . 11.1 tp -123.18 116.12 22.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 73.340000000000003 110.897 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.42 ' CG2' HD12 ' A' ' 14' ' ' LEU . 57.7 t -90.53 116.19 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 75.120000000000005 111.152 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.778 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 10.5 t60 -152.29 126.73 9.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 71.019999999999996 110.874 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 62.29 42.79 8.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.26 -0.427 . . . . 63.340000000000003 110.914 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.7 m 55.22 27.73 10.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.487 . . . . 73.430000000000007 110.847 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -125.99 -176.49 3.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 74.109999999999999 110.893 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 19.4 mt -135.33 131.99 37.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 73.230000000000004 110.895 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.515 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -126.7 168.77 13.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.473 . . . . 75.219999999999999 110.968 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -127.97 138.92 52.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 72.310000000000002 110.888 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.501 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 33.6 tttp -63.2 112.38 2.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 74.140000000000001 110.936 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -86.73 -58.39 2.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 72.439999999999998 110.921 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.411 ' NZ ' ' CD2' ' A' ' 41' ' ' TYR . 18.5 pttm -146.88 -177.58 5.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.145 -0.48 . . . . 74.230000000000004 110.864 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -144.41 121.83 11.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 75.430000000000007 111.184 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.5 51.11 2.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 73.549999999999997 111.121 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.94 -59.8 3.05 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.799 -0.715 . . . . 64.219999999999999 112.501 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.413 ' CD ' ' N ' ' A' ' 38' ' ' GLU . 13.5 mp0 -112.91 -30.19 7.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.896 0.379 . . . . 75.140000000000001 110.861 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -94.1 153.77 17.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 74.219999999999999 110.872 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.2 t -129.24 115.34 35.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.267 -0.424 . . . . 74.340000000000003 111.144 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.494 ' CZ ' HD13 ' A' ' 57' ' ' ILE . 3.0 m-85 -80.76 144.21 32.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 73.099999999999994 110.898 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.501 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 72.0 m95 -135.04 163.22 30.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 74.409999999999997 110.902 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.9 ptt? -148.19 131.59 16.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 73.340000000000003 110.932 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.0 t -42.31 115.31 0.67 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.289 -0.414 . . . . 71.25 110.812 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 39.4 ptt85 -50.5 -18.96 0.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 73.400000000000006 110.886 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.425 ' HB3' ' CD1' ' A' ' 50' ' ' LEU . 6.2 m-20 -88.26 32.06 0.78 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.461 . . . . 74.430000000000007 110.87 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.54 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -84.6 -14.53 48.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 73.0 110.865 -179.891 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.04 -46.3 6.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 75.25 111.133 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.1 ttt180 -84.48 -55.23 4.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.196 -0.456 . . . . 75.340000000000003 110.82 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.544 HD12 ' CD2' ' A' ' 71' ' ' HIS . 64.6 mt -88.07 9.56 22.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.289 -0.414 . . . . 74.530000000000001 110.957 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.8 35.48 2.18 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.746 -0.74 . . . . 70.109999999999999 112.47 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.412 ' N ' ' HA ' ' A' ' 47' ' ' GLN . 32.2 t -78.5 125.52 29.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.787 0.327 . . . . 71.120000000000005 110.878 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.65 19.31 18.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 75.140000000000001 110.863 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.7 t -69.64 125.67 27.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 64.340000000000003 110.855 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -122.48 159.52 27.48 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.164 -0.471 . . . . 65.129999999999995 110.91 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -151.74 149.48 29.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 41.520000000000003 111.075 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.494 HD13 ' CZ ' ' A' ' 41' ' ' TYR . 61.4 mt -117.7 131.08 71.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 74.109999999999999 111.139 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.1 p -115.66 144.69 43.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 64.239999999999995 111.217 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -130.39 94.66 3.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 72.120000000000005 110.96 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 78.55 -85.65 1.15 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.78 -0.724 . . . . 74.129999999999995 112.489 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -128.07 5.29 5.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.768 0.318 . . . . 72.099999999999994 110.854 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -102.8 176.98 4.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.206 -0.452 . . . . 73.450000000000003 110.835 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.552 HD11 ' CD2' ' A' ' 25' ' ' HIS . 18.3 tt -150.79 149.82 13.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.126 -0.488 . . . . 74.200000000000003 111.115 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.444 ' N ' ' O ' ' A' ' 57' ' ' ILE . 53.7 mtm -138.27 140.12 39.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 75.120000000000005 110.862 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.778 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 66.8 t -99.43 142.21 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 71.209999999999994 111.101 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 29.0 mmm -103.4 -62.25 1.31 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 65.230000000000004 110.926 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 -114.99 -175.75 2.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.305 -0.407 . . . . 75.109999999999999 110.882 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.7 p -96.91 -175.57 3.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 74.239999999999995 110.892 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.453 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 69.5 m-70 -117.74 135.31 54.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 71.230000000000004 110.866 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.3 t -90.1 14.94 11.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 74.340000000000003 110.927 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.544 ' CD2' HD12 ' A' ' 50' ' ' LEU . 25.2 p80 -143.36 162.29 36.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 75.329999999999998 110.829 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -93.59 152.84 41.17 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.645 0.736 . . . . 71.329999999999998 110.874 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 154.92 67.18 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.702 2.268 . . . . 72.299999999999997 112.375 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.26 82.34 2.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 75.140000000000001 110.897 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.1 mt -53.79 -16.32 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 74.430000000000007 110.906 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.05 -52.6 13.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 73.519999999999996 111.102 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.9 -30.11 64.03 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.666 -0.778 . . . . 65.299999999999997 112.442 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.6 tp -73.03 -46.06 54.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.86 0.362 . . . . 75.439999999999998 110.922 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.57 -36.51 78.67 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.216 -0.447 . . . . 65.420000000000002 110.837 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.47 -32.11 66.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 70.400000000000006 111.115 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.6 mt -73.57 -42.69 61.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 74.420000000000002 110.903 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.406 ' NH1' ' CD ' ' A' ' 12' ' ' GLU . 1.6 mpp_? -76.49 -20.68 56.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 71.540000000000006 110.865 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -86.98 -38.15 16.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 65.409999999999997 110.963 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.28 -7.29 58.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 74.219999999999999 110.839 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -92.28 -64.15 1.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 72.120000000000005 110.829 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.2 mtp180 -65.03 174.53 1.91 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 54.240000000000002 110.909 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.506 ' C ' ' CD1' ' A' ' 87' ' ' LEU . 2.5 tm? . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 75.310000000000002 110.898 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.277 0 N-CA-C 112.457 -0.257 . . . . 71.430000000000007 112.457 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.0 t -133.7 160.27 38.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.838 0.352 . . . . 74.129999999999995 110.833 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.9 m -122.87 100.38 6.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 72.540000000000006 110.821 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.65 -123.67 5.31 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.761 -0.733 . . . . 72.340000000000003 112.453 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.5 m -136.16 149.14 48.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.843 0.354 . . . . 73.109999999999999 110.874 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.0 p -101.21 -179.86 4.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.127 -0.488 . . . . 74.530000000000001 110.881 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.89 -116.03 0.7 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.727 -0.749 . . . . 64.340000000000003 112.471 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.435 ' CD1' ' HB3' ' A' ' 62' ' ' ARG . 3.4 tp -113.7 101.61 9.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.806 0.336 . . . . 74.5 110.932 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.424 ' CD ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -75.22 144.5 78.73 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.605 0.717 . . . . 74.540000000000006 110.832 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.424 ' HD2' ' CD ' ' A' ' 9' ' ' ARG . 53.6 Cg_endo -69.72 -166.71 0.19 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.679 2.253 . . . . 44.210000000000001 112.338 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.445 ' H ' ' CE1' ' A' ' 61' ' ' HIS . 11.7 tp -158.05 145.61 18.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 72.230000000000004 110.853 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -104.47 136.24 44.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.131 -0.486 . . . . 65.230000000000004 110.902 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -126.85 163.4 23.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 73.239999999999995 110.904 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.444 HD12 ' CG2' ' A' ' 24' ' ' VAL . 1.4 mt -148.9 153.31 37.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.136 -0.483 . . . . 71.120000000000005 110.893 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 ppt_? -127.85 149.91 50.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 73.150000000000006 110.84 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.44 ' CG2' ' O ' ' A' ' 20' ' ' GLY . 2.3 p -107.21 -176.12 2.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 72.430000000000007 111.182 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.434 ' C ' ' O ' ' A' ' 16' ' ' THR . 49.2 m -34.79 -75.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 74.439999999999998 110.848 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.47 ' N ' ' CD2' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -131.3 139.98 49.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 73.310000000000002 110.928 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.428 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 35.83 68.46 0.28 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.723 -0.751 . . . . 63.240000000000002 112.506 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.44 ' O ' ' CG2' ' A' ' 16' ' ' THR . . . -157.23 75.57 0.21 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.755 -0.736 . . . . 75.510000000000005 112.444 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.1 tpp180 -96.5 116.93 29.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.738 0.304 . . . . 73.25 110.916 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -99.0 168.93 9.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 75.430000000000007 110.914 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.431 HD22 ' CG ' ' A' ' 42' ' ' TRP . 7.9 tp -123.85 114.13 19.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.112 -0.494 . . . . 72.430000000000007 110.894 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.444 ' CG2' HD12 ' A' ' 14' ' ' LEU . 43.0 t -90.74 110.75 22.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.45 . . . . 75.239999999999995 111.106 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.562 ' CD2' HD11 ' A' ' 63' ' ' ILE . 32.6 t60 -147.65 125.07 11.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 74.420000000000002 110.868 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 63.24 38.41 10.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.243 -0.435 . . . . 70.540000000000006 110.863 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.2 t 62.6 15.41 7.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 62.329999999999998 110.898 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -112.59 177.58 4.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.115 -0.493 . . . . 75.140000000000001 110.884 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.6 mt -132.46 129.7 39.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 74.129999999999995 110.927 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.498 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.2 m-85 -124.53 175.4 7.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 75.5 110.897 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 30.0 mtp180 -133.47 139.22 46.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 74.150000000000006 110.852 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -64.75 111.14 2.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 73.310000000000002 110.93 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -86.96 -57.91 2.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 75.510000000000005 110.909 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.75 167.89 27.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 73.040000000000006 110.881 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -127.38 131.61 50.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.224 -0.444 . . . . 74.540000000000006 111.093 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -117.71 100.05 7.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 62.049999999999997 111.129 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.33 -96.44 0.2 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.705 -0.76 . . . . 72.310000000000002 112.431 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -113.55 2.34 15.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.91 0.386 . . . . 74.239999999999995 110.896 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -105.07 157.6 17.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 75.5 110.847 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.5 t -136.66 116.67 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 65.439999999999998 111.137 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -79.09 146.71 33.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 73.510000000000005 110.956 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.431 ' CG ' HD22 ' A' ' 23' ' ' LEU . 69.1 m95 -136.51 167.38 21.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 71.310000000000002 110.981 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.6 ptt? -152.52 132.64 13.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.427 . . . . 71.040000000000006 110.86 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -45.43 113.93 0.67 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.215 -0.448 . . . . 73.439999999999998 110.893 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 18.0 ptt180 -54.89 -28.74 52.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 73.400000000000006 110.87 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.47 48.19 1.54 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 61.119999999999997 110.866 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -84.76 -37.04 21.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 74.129999999999995 110.95 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.17 -12.9 29.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 72.349999999999994 111.078 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.94 -40.99 7.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 74.209999999999994 110.855 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.416 ' O ' ' C ' ' A' ' 51' ' ' GLY . 90.3 mt -114.76 23.99 12.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 71.230000000000004 110.886 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.96 53.14 0.86 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.707 -0.759 . . . . 73.510000000000005 112.5 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.61 118.45 25.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.86 0.362 . . . . 75.439999999999998 110.897 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.8 mmt85 -105.58 50.23 0.78 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 73.329999999999998 110.815 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.3 t -87.33 117.26 25.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 74.120000000000005 110.806 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -105.15 161.55 14.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.141 -0.481 . . . . 74.109999999999999 110.902 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.484 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -148.08 163.01 38.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 64.150000000000006 111.059 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 70.2 mt -127.32 127.79 69.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 75.030000000000001 111.117 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.429 HG23 ' NE1' ' A' ' 42' ' ' TRP . 42.1 p -110.94 144.31 40.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 74.230000000000004 111.191 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -128.46 90.29 3.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.415 . . . . 74.030000000000001 110.995 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.95 -86.73 0.97 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.732 -0.747 . . . . 61.310000000000002 112.456 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.445 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.5 OUTLIER -124.68 7.87 8.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.771 0.32 . . . . 73.120000000000005 110.854 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.44 ' HG3' ' N ' ' A' ' 63' ' ' ILE . 10.3 ptt180 -105.82 180.0 4.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 72.340000000000003 110.831 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.562 HD11 ' CD2' ' A' ' 25' ' ' HIS . 17.5 tt -151.0 153.8 9.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 74.430000000000007 111.166 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.484 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 30.3 ttp -144.3 147.1 33.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 63.32 110.924 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 t -116.88 145.69 22.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 71.310000000000002 111.125 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 2.4 mtt -112.38 -62.31 1.59 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 72.299999999999997 110.871 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 -96.32 177.48 5.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.277 -0.42 . . . . 74.230000000000004 110.836 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.7 m -100.64 174.02 6.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 65.420000000000002 110.819 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.411 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 74.4 m-70 -107.88 127.69 53.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 73.209999999999994 110.85 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 8.2 t -82.53 14.74 2.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 73.420000000000002 110.897 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 27.8 p80 -145.12 153.12 41.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 75.040000000000006 110.842 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -86.8 152.49 54.01 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.621 0.724 . . . . 74.010000000000005 110.89 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 152.85 69.54 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.676 2.251 . . . . 60.130000000000003 112.377 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.55 90.95 3.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 62.43 110.878 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 18.8 mt -58.69 -31.13 67.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 72.450000000000003 110.92 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -68.58 -31.97 71.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 63.210000000000001 111.153 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -88.54 -37.5 7.48 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.675 -0.774 . . . . 62.520000000000003 112.534 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.422 ' CD1' HG13 ' A' ' 24' ' ' VAL . 10.2 tp -72.6 -40.09 66.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.722 0.296 . . . . 72.430000000000007 110.892 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.546 ' N ' HH21 ' A' ' 82' ' ' ARG . 30.8 mm-40 -64.22 -30.35 71.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 63.219999999999999 110.867 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.412 ' O ' ' N ' ' A' ' 83' ' ' GLN . . . -65.12 -59.53 4.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 54.409999999999997 111.095 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.4 mt -39.47 -43.46 1.25 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.97 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.546 HH21 ' N ' ' A' ' 79' ' ' GLU . 55.6 mtm180 -65.29 -42.17 93.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.101 -0.5 . . . . 74.540000000000006 110.878 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.438 ' HG2' ' N ' ' A' ' 84' ' ' ARG . 2.1 pt20 -40.94 -33.65 0.33 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 71.230000000000004 110.962 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.438 ' N ' ' HG2' ' A' ' 83' ' ' GLN . 58.0 mtt180 -70.68 -45.55 64.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 75.530000000000001 110.852 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.23 -66.99 0.55 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.225 -0.443 . . . . 74.519999999999996 110.812 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.437 ' C ' ' CD ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -96.78 170.24 9.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 74.25 110.802 -179.857 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 14.0 tp . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 72.310000000000002 110.962 -179.987 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.493 -0.243 . . . . 52.450000000000003 112.493 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m 61.16 33.12 19.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.939 0.4 . . . . 74.329999999999998 110.871 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.4 t -119.58 65.01 0.8 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 74.519999999999996 110.911 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 111.41 95.56 2.29 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.808 -0.711 . . . . 72.510000000000005 112.511 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.6 p -138.43 119.81 14.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.886 0.374 . . . . 54.039999999999999 110.884 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 17.5 t -99.66 80.85 2.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 72.109999999999999 110.842 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 154.0 -43.95 0.59 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.684 -0.769 . . . . 54.520000000000003 112.428 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 28.3 tp -91.9 106.7 18.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.801 0.334 . . . . 71.129999999999995 110.965 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -81.29 145.77 56.58 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.561 0.696 . . . . 75.030000000000001 110.896 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -165.25 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.608 2.205 . . . . 71.129999999999995 112.294 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.41 HD21 ' CZ ' ' A' ' 13' ' ' PHE . 25.9 tp -167.55 144.42 4.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 63.549999999999997 110.933 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -102.32 150.0 23.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 73.340000000000003 110.908 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.479 ' CE2' HD12 ' A' ' 23' ' ' LEU . 37.1 m-85 -139.42 172.05 13.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.114 -0.494 . . . . 74.420000000000002 110.914 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.9 mt -144.45 151.78 39.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 73.040000000000006 110.94 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 79.1 mtm-85 -124.25 117.55 24.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.269 -0.423 . . . . 74.129999999999995 110.866 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.6 p -92.96 176.36 6.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 75.129999999999995 111.155 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 62.7 m -106.73 -68.99 0.85 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 73.109999999999999 110.839 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.6 mt -84.11 36.44 0.57 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 74.109999999999999 110.879 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.98 -105.85 0.3 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.743 -0.741 . . . . 72.230000000000004 112.451 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -162.64 -143.32 3.65 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.756 -0.735 . . . . 75.219999999999999 112.523 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -102.4 130.33 49.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.924 0.392 . . . . 74.400000000000006 110.842 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -107.45 158.79 16.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 71.519999999999996 110.875 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.479 HD12 ' CE2' ' A' ' 13' ' ' PHE . 8.9 tp -125.1 114.64 19.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.16 -0.473 . . . . 73.349999999999994 110.91 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 53.5 t -87.96 119.46 35.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 74.150000000000006 111.124 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.556 ' CD2' HD12 ' A' ' 63' ' ' ILE . 25.2 t60 -156.45 126.17 6.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.247 -0.433 . . . . 71.439999999999998 110.937 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 61.53 41.07 12.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.234 -0.439 . . . . 75.030000000000001 110.87 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 10.3 m 58.37 32.44 22.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.091 -0.504 . . . . 74.310000000000002 110.858 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.43 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 16.7 m-85 -131.41 -175.48 3.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 65.010000000000005 110.938 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.442 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 29.3 mt -140.63 133.23 28.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 74.299999999999997 110.886 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.51 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.1 m-85 -127.89 162.64 26.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 75.239999999999995 110.915 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.5 mtp180 -120.74 136.16 54.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 75.230000000000004 110.897 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 38.5 tttp -58.66 112.07 1.49 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 75.340000000000003 110.97 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.44 ' OE1' ' NH2' ' A' ' 55' ' ' ARG . 1.6 tm-20 -82.87 -51.22 7.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.431 . . . . 73.099999999999994 110.937 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.548 ' CD ' ' CD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -158.52 179.12 9.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 74.340000000000003 110.898 179.935 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -130.78 135.31 47.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 63.0 111.098 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -118.76 -172.58 2.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 51.009999999999998 111.111 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.25 92.12 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 74.239999999999995 112.478 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 66.71 43.24 2.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.917 0.389 . . . . 71.109999999999999 110.914 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -154.26 159.18 41.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 71.340000000000003 110.882 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.459 HG11 ' CE2' ' A' ' 42' ' ' TRP . 14.3 t -135.78 121.01 28.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 73.519999999999996 111.096 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.548 ' CD1' ' CD ' ' A' ' 34' ' ' LYS . 8.9 m-85 -85.39 149.12 25.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 75.230000000000004 110.914 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.459 ' CE2' HG11 ' A' ' 40' ' ' VAL . 70.0 m95 -143.0 149.76 38.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 74.310000000000002 110.914 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -135.36 130.83 35.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 73.109999999999999 110.913 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.432 ' O ' ' N ' ' A' ' 46' ' ' ASP . 2.2 t -46.59 107.56 0.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 73.129999999999995 110.861 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.442 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.7 ptt-85 -40.23 -27.28 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 72.219999999999999 110.843 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 44' ' ' CYS . 0.3 OUTLIER -88.8 40.52 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 71.239999999999995 110.845 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -86.43 -37.46 18.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 73.519999999999996 110.909 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.62 -15.08 23.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 74.510000000000005 111.079 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.8 tpp180 -92.41 -61.93 1.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 73.230000000000004 110.89 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.1 mt -103.54 29.17 5.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 73.310000000000002 110.954 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.59 47.31 4.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.757 -0.735 . . . . 74.140000000000001 112.501 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.2 t -105.5 72.86 0.99 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.893 0.378 . . . . 65.329999999999998 110.931 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.462 ' HD2' ' N ' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -55.88 -13.88 2.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.12 -0.491 . . . . 75.400000000000006 110.828 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.451 ' N ' ' HD3' ' A' ' 53' ' ' ARG . 3.4 t -35.55 122.72 0.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 54.450000000000003 110.89 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.44 ' NH2' ' OE1' ' A' ' 33' ' ' GLU . 37.5 mtp180 -118.71 177.06 4.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 72.349999999999994 110.876 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -161.62 151.4 16.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 53.520000000000003 111.091 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.433 ' O ' ' N ' ' A' ' 64' ' ' MET . 61.7 mt -121.84 133.63 67.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 73.099999999999994 111.098 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.7 p -116.01 144.39 44.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 71.430000000000007 111.146 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -126.79 88.94 2.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 74.230000000000004 110.928 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 81.55 -86.92 1.39 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.711 -0.757 . . . . 72.329999999999998 112.417 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.403 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -126.03 8.12 7.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.752 0.31 . . . . 74.349999999999994 110.845 -179.885 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.409 ' HG3' ' N ' ' A' ' 63' ' ' ILE . 8.2 ptm180 -106.42 179.82 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 71.109999999999999 110.867 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.556 HD12 ' CD2' ' A' ' 25' ' ' HIS . 20.4 tt -150.95 151.73 12.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 71.140000000000001 111.162 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.433 ' N ' ' O ' ' A' ' 57' ' ' ILE . 3.9 mpp? -140.91 140.11 34.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 71.519999999999996 110.904 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.5 t -109.8 140.25 29.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 75.349999999999994 111.085 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 6.8 mmt -104.0 -53.78 2.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.153 -0.476 . . . . 73.420000000000002 110.864 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.3 mtp85 -115.05 167.67 10.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 74.409999999999997 110.93 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.0 m -86.54 -175.76 5.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 74.099999999999994 110.848 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 63.6 m-70 -118.85 137.3 53.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.17 -0.468 . . . . 75.420000000000002 110.841 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 16.6 t -91.29 9.99 29.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 51.200000000000003 110.786 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 33.0 p80 -138.23 157.3 46.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 75.329999999999998 110.916 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -89.96 156.49 46.81 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.599 0.714 . . . . 74.230000000000004 110.898 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.43 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 54.0 Cg_endo -69.7 140.19 42.31 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.727 2.285 . . . . 62.200000000000003 112.335 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -102.53 80.95 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 72.209999999999994 110.903 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 57.2 mt -53.78 -16.47 1.74 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 71.120000000000005 110.963 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.22 -57.65 2.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.441 . . . . 70.540000000000006 111.073 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.79 -33.67 83.89 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.726 -0.749 . . . . 74.129999999999995 112.453 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.9 tp -70.53 -49.52 47.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.784 0.326 . . . . 75.420000000000002 110.936 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -62.24 -31.75 72.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 63.109999999999999 110.844 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.61 -54.57 22.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 73.099999999999994 111.063 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 15.8 mt -56.19 -32.39 64.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 61.109999999999999 110.928 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 6.5 mtp-105 -59.99 -36.04 76.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 75.219999999999999 110.917 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.432 ' HG3' ' N ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -57.48 -35.56 70.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.478 . . . . 75.209999999999994 110.852 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.458 ' CB ' ' CZ ' ' A' ' 84' ' ' ARG . 1.5 mtp-105 -69.66 -12.5 61.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 73.230000000000004 110.876 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.432 ' HG3' ' N ' ' A' ' 86' ' ' ARG . 2.6 tp10 -102.49 -52.64 3.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 71.25 110.933 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.432 ' N ' ' HG3' ' A' ' 85' ' ' GLU . 15.6 mmm180 -48.02 145.63 2.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.479 . . . . 63.32 110.867 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.466 ' CD2' ' C ' ' A' ' 87' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.225 -0.443 . . . . 75.329999999999998 110.88 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 112.495 -0.242 . . . . 54.539999999999999 112.495 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 t -72.01 145.79 48.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.888 0.375 . . . . 64.310000000000002 110.84 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 p -135.26 140.94 45.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.096 -0.502 . . . . 75.349999999999994 110.896 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.12 -178.61 36.15 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.711 -0.757 . . . . 74.450000000000003 112.455 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 t -93.53 155.57 17.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.814 0.34 . . . . 64.5 110.885 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.9 m -124.86 158.16 34.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 75.319999999999993 110.851 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 107.84 -106.43 2.39 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.767 -0.73 . . . . 71.439999999999998 112.461 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.415 ' CD1' ' HG3' ' A' ' 62' ' ' ARG . 6.0 tp -82.46 85.34 6.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.82 0.343 . . . . 72.310000000000002 110.94 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.45 ' N ' ' HD3' ' A' ' 62' ' ' ARG . 5.7 mtp-105 -75.87 144.13 75.73 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.526 0.679 . . . . 73.420000000000002 110.887 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.463 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 53.9 Cg_endo -69.68 -176.1 1.36 Allowed 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.669 2.246 . . . . 64.109999999999999 112.36 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.555 HD21 ' CZ ' ' A' ' 13' ' ' PHE . 22.6 tp -135.12 154.06 51.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 74.329999999999998 110.925 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.468 ' C ' ' CD1' ' A' ' 13' ' ' PHE . 4.8 tp10 -118.57 150.03 40.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 72.140000000000001 110.881 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.555 ' CZ ' HD21 ' A' ' 11' ' ' LEU . 1.9 m-85 -139.97 168.05 20.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 74.030000000000001 110.865 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.402 ' CD2' ' HA ' ' A' ' 82' ' ' ARG . 8.6 mt -135.26 117.24 15.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.17 -0.468 . . . . 75.099999999999994 110.896 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.3 ttt-85 -72.35 135.66 45.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 73.340000000000003 110.842 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.542 HG21 ' CD2' ' A' ' 22' ' ' PHE . 1.1 p -116.58 168.13 10.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 75.439999999999998 111.122 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.3 t -107.87 -52.48 2.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.181 -0.463 . . . . 71.530000000000001 110.854 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mt -66.65 -55.09 16.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 74.230000000000004 110.938 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -84.33 -103.77 0.59 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.746 -0.74 . . . . 74.450000000000003 112.445 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.424 ' N ' ' OG1' ' A' ' 16' ' ' THR . . . -155.38 -102.51 0.2 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.708 -0.758 . . . . 72.030000000000001 112.444 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 tpp85 -119.88 150.1 41.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.856 0.36 . . . . 74.340000000000003 110.848 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.542 ' CD2' HG21 ' A' ' 16' ' ' THR . 2.9 m-85 -116.01 160.59 20.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 72.150000000000006 110.833 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.42 ' CD1' HD21 ' A' ' 11' ' ' LEU . 8.1 tp -122.63 113.89 19.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.065 -0.516 . . . . 73.219999999999999 110.908 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 88.8 t -88.6 117.57 32.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 73.530000000000001 111.115 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.464 ' CE1' HG22 ' A' ' 63' ' ' ILE . 8.4 t60 -153.22 124.88 7.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 70.299999999999997 110.889 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 62.17 45.3 7.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.278 -0.419 . . . . 64.010000000000005 110.909 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 53.61 21.95 2.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.139 -0.482 . . . . 75.230000000000004 110.831 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -119.57 -179.95 4.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 63.43 110.902 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.421 HD11 ' CZ ' ' A' ' 45' ' ' ARG . 43.6 mt -129.91 136.99 50.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 74.549999999999997 110.924 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.519 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -133.6 167.06 21.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 73.420000000000002 110.936 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.8 mtp180 -130.34 138.27 50.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 73.209999999999994 110.874 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 31.4 tttm -57.12 119.92 7.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.219 -0.446 . . . . 74.129999999999995 110.897 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -95.83 -55.09 3.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.282 -0.417 . . . . 74.140000000000001 110.876 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 45.5 pttt -151.13 178.68 8.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.107 -0.497 . . . . 75.329999999999998 110.864 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.02 121.21 15.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 62.229999999999997 111.19 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.4 56.74 3.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 63.140000000000001 111.094 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.31 -65.75 3.77 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.739 -0.743 . . . . 60.32 112.492 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -117.37 -20.87 8.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.883 0.373 . . . . 72.040000000000006 110.87 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.4 mtmm -93.4 161.32 14.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 75.040000000000006 110.937 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 t -137.03 116.12 15.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.29 -0.414 . . . . 74.209999999999994 111.12 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -81.67 149.78 28.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 71.409999999999997 110.929 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.511 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 62.9 m95 -138.75 158.59 43.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.102 -0.499 . . . . 64.420000000000002 110.857 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 7.0 ptt? -142.24 137.97 31.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 73.310000000000002 110.867 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.41 ' C ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -46.42 108.39 0.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 75.319999999999993 110.906 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.421 ' CZ ' HD11 ' A' ' 29' ' ' LEU . 19.6 ptt180 -44.4 -22.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 71.450000000000003 110.848 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.41 ' N ' ' C ' ' A' ' 44' ' ' CYS . 0.5 OUTLIER -84.09 35.79 0.54 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.438 . . . . 70.420000000000002 110.904 179.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.4 ' HG3' ' N ' ' A' ' 48' ' ' ALA . 0.5 OUTLIER -48.27 -65.28 0.59 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.182 -0.463 . . . . 71.430000000000007 110.941 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.4 ' N ' ' HG3' ' A' ' 47' ' ' GLN . . . -92.56 -33.07 14.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.226 -0.443 . . . . 73.530000000000001 111.096 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.75 -46.2 70.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.235 -0.439 . . . . 73.519999999999996 110.928 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.453 HD13 ' CG ' ' A' ' 71' ' ' HIS . 58.7 mt -123.69 25.93 7.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 73.209999999999994 110.872 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 39.36 43.94 2.16 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.694 -0.765 . . . . 71.209999999999994 112.529 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.4 t -96.89 148.24 23.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.35 . . . . 74.319999999999993 110.854 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.79 33.91 3.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.182 -0.463 . . . . 73.239999999999995 110.902 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.5 t -84.9 118.18 24.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 73.430000000000007 110.854 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -112.29 146.55 38.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 74.140000000000001 110.837 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.409 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -137.41 157.33 46.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 71.530000000000001 111.139 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 84.7 mt -123.18 126.16 73.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 73.230000000000004 111.074 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.445 HG23 ' NE1' ' A' ' 42' ' ' TRP . 43.0 p -102.02 152.15 21.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 71.430000000000007 111.131 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.8 tm0? -154.61 108.03 2.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 73.450000000000003 110.87 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.02 -97.35 0.92 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.774 -0.727 . . . . 72.140000000000001 112.571 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.463 ' CD2' ' HA ' ' A' ' 10' ' ' PRO . 1.7 t60 -128.77 11.25 6.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.812 0.339 . . . . 74.549999999999997 110.81 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.45 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 11.0 mmm180 -117.63 176.4 5.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 75.329999999999998 110.863 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.464 HG22 ' CE1' ' A' ' 25' ' ' HIS . 21.2 tt -143.92 159.43 16.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 75.230000000000004 111.147 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.409 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 5.6 ttp -135.72 148.97 49.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 75.120000000000005 110.914 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.6 t -120.13 142.61 35.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 72.329999999999998 111.139 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.4 mtp -117.73 -63.48 1.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 73.530000000000001 110.888 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -89.61 171.24 9.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 74.319999999999993 110.809 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -103.44 174.04 6.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.102 -0.499 . . . . 73.120000000000005 110.841 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.449 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 62.2 m-70 -110.09 132.66 53.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.49 . . . . 72.120000000000005 110.837 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 2.1 t -90.26 13.87 14.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 74.530000000000001 110.896 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.453 ' CG ' HD13 ' A' ' 50' ' ' LEU . 27.1 p80 -140.33 156.9 46.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 70.030000000000001 110.816 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -92.49 155.3 42.37 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 121.565 0.697 . . . . 71.439999999999998 110.883 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 162.23 42.87 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.659 2.239 . . . . 74.25 112.327 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.36 79.93 1.73 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 74.430000000000007 110.829 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.0 mt -46.35 -23.24 0.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 71.219999999999999 110.955 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.59 -40.93 72.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 54.219999999999999 111.111 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -80.44 -40.5 12.94 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.754 -0.736 . . . . 64.310000000000002 112.48 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.1 tp -65.77 -39.63 91.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.78 0.324 . . . . 72.310000000000002 110.909 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -63.64 -31.95 73.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 74.510000000000005 110.9 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.67 -31.57 72.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.491 . . . . 75.340000000000003 111.097 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.8 mt -79.35 -28.26 42.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 73.219999999999999 110.934 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.402 ' HA ' ' CD2' ' A' ' 14' ' ' LEU . 69.5 mtp180 -80.24 -35.19 36.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 74.450000000000003 110.84 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.429 ' HG3' ' N ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -59.45 -34.78 72.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 72.209999999999994 110.97 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.429 ' N ' ' HG3' ' A' ' 83' ' ' GLN . 10.1 ptt180 -83.92 -4.32 58.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 73.510000000000005 110.838 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -103.14 -30.24 10.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 75.430000000000007 110.857 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -103.55 73.41 1.19 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 72.239999999999995 110.879 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.8 tp . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.123 -0.49 . . . . 74.439999999999998 110.943 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 N-CA-C 112.5 -0.24 . . . . 73.200000000000003 112.5 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.4 p -120.25 116.1 24.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.954 0.407 . . . . 73.010000000000005 110.857 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.6 t -107.49 -16.13 14.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.09 -0.504 . . . . 70.109999999999999 110.834 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 151.89 -161.32 29.25 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.713 -0.756 . . . . 72.129999999999995 112.508 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.0 t -115.1 122.47 46.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.905 0.383 . . . . 53.030000000000001 110.802 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.2 t -122.08 164.83 17.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.086 -0.506 . . . . 71.510000000000005 110.857 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.63 -21.08 74.53 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.824 -0.703 . . . . 74.299999999999997 112.436 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.5 tp -71.14 88.77 0.81 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.852 0.358 . . . . 74.239999999999995 110.96 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 -81.31 144.03 53.11 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.584 0.707 . . . . 74.400000000000006 110.85 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 178.82 4.16 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.67 2.246 . . . . 72.340000000000003 112.382 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.47 ' H ' ' CE1' ' A' ' 61' ' ' HIS . 20.7 tp -140.82 150.02 42.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 74.129999999999995 110.877 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -107.31 151.67 25.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 72.150000000000006 110.849 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.539 ' CD2' HD11 ' A' ' 23' ' ' LEU . 72.1 m-85 -137.22 172.96 12.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.121 -0.49 . . . . 75.450000000000003 110.83 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.407 ' O ' ' CD ' ' A' ' 21' ' ' ARG . 16.6 mt -147.81 174.1 12.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.088 -0.506 . . . . 75.450000000000003 110.937 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -127.78 150.07 49.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 75.349999999999994 110.816 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.6 p -107.84 172.22 6.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.157 -0.474 . . . . 73.420000000000002 111.083 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.4 m -75.31 -65.87 0.84 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 73.430000000000007 110.824 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.511 ' N ' ' CD2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -68.24 71.15 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 75.329999999999998 110.932 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.439 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 34.72 83.94 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.745 -0.74 . . . . 61.539999999999999 112.533 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -158.75 170.91 35.34 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.751 -0.737 . . . . 71.510000000000005 112.5 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.407 ' CD ' ' O ' ' A' ' 14' ' ' LEU . 12.1 tpt180 -141.23 135.66 30.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.786 0.327 . . . . 62.409999999999997 110.916 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -107.42 158.67 16.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 64.099999999999994 110.936 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.539 HD11 ' CD2' ' A' ' 13' ' ' PHE . 13.1 tp -124.11 115.96 22.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.466 . . . . 74.209999999999994 110.935 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.3 t -90.35 115.51 29.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 64.010000000000005 111.086 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.564 ' CD2' HD12 ' A' ' 63' ' ' ILE . 29.7 t60 -153.49 132.77 12.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 74.310000000000002 110.809 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 60.02 33.16 21.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 75.439999999999998 110.967 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.8 m 65.43 29.23 11.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.119 -0.491 . . . . 54.32 110.909 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.452 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 14.8 m-85 -130.74 -174.68 3.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.109 -0.496 . . . . 64.439999999999998 110.848 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.422 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 9.8 mt -138.86 132.7 30.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.108 -0.496 . . . . 74.140000000000001 110.967 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.522 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -125.96 166.92 16.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.19 -0.459 . . . . 75.099999999999994 110.973 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -126.29 126.42 43.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.132 -0.486 . . . . 75.5 110.843 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -45.18 108.58 0.13 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.151 -0.477 . . . . 64.340000000000003 110.878 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -82.89 -53.41 5.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 73.120000000000005 110.927 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.442 ' HD2' ' CG ' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -159.16 178.8 9.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.083 -0.508 . . . . 74.310000000000002 110.923 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -130.52 128.61 41.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.446 . . . . 63.539999999999999 111.068 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.41 19.91 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 75.530000000000001 111.07 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 90.86 -49.65 3.1 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.731 -0.747 . . . . 74.230000000000004 112.472 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -111.32 -18.83 12.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.922 0.391 . . . . 71.209999999999994 110.866 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.451 ' HB3' ' CG2' ' A' ' 57' ' ' ILE . 9.9 mtmm -123.02 170.64 9.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.236 -0.438 . . . . 73.540000000000006 110.938 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.441 ' O ' ' CD1' ' A' ' 42' ' ' TRP . 4.7 t -133.53 119.13 33.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.236 -0.438 . . . . 71.319999999999993 111.114 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.442 ' CG ' ' HD2' ' A' ' 34' ' ' LYS . 2.9 m-85 -75.79 150.3 37.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.113 -0.494 . . . . 74.420000000000002 110.922 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.441 ' CD1' ' O ' ' A' ' 40' ' ' VAL . 75.3 m95 -142.92 121.96 12.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.106 -0.497 . . . . 64.299999999999997 110.892 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -106.26 136.06 46.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.239 -0.437 . . . . 72.230000000000004 110.877 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.6 t -50.4 113.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 74.140000000000001 110.924 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 20.7 ptt-85 -44.66 -35.16 2.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 74.230000000000004 110.927 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.69 44.31 0.62 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 74.420000000000002 110.902 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -88.77 -26.18 21.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 75.439999999999998 110.914 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.77 -30.72 12.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 61.420000000000002 111.106 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.434 ' CB ' ' CZ ' ' A' ' 49' ' ' ARG . 4.5 ttp-105 -89.04 -62.34 1.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 73.420000000000002 110.855 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.417 HD11 ' CD2' ' A' ' 71' ' ' HIS . 88.5 mt -90.37 20.31 4.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 72.430000000000007 110.867 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 36.72 36.88 0.19 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.721 -0.752 . . . . 72.099999999999994 112.512 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.7 t -89.33 120.67 30.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.791 0.329 . . . . 74.439999999999998 110.877 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 40.8 mmm-85 -98.75 13.75 31.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.456 . . . . 74.549999999999997 110.857 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.507 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 23.2 t -61.26 108.21 0.88 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 74.540000000000006 110.94 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.43 ' CB ' ' CZ ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -111.08 164.33 12.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 71.340000000000003 110.868 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.473 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -157.23 159.93 38.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.420000000000002 111.13 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.451 ' CG2' ' HB3' ' A' ' 39' ' ' LYS . 74.6 mt -123.98 128.49 74.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.234 -0.439 . . . . 74.329999999999998 111.16 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.43 HG21 ' NE1' ' A' ' 42' ' ' TRP . 30.0 p -101.29 144.21 30.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 55.020000000000003 111.14 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.56 111.02 6.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 73.430000000000007 110.88 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 68.73 -94.77 0.36 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.717 -0.754 . . . . 74.040000000000006 112.505 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.47 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -128.68 7.28 5.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.832 0.348 . . . . 75.129999999999995 110.894 -179.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -112.41 178.82 4.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 73.150000000000006 110.872 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.564 HD12 ' CD2' ' A' ' 25' ' ' HIS . 20.2 tt -145.74 157.87 12.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 75.219999999999999 111.172 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.473 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 2.7 ttp -135.31 140.66 45.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 74.420000000000002 110.804 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.422 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 61.1 t -106.37 143.22 17.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 74.409999999999997 111.162 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.0 mtp -117.96 -55.21 2.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 74.439999999999998 110.897 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -110.75 144.91 38.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 74.310000000000002 110.828 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.3 p -75.39 168.71 19.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 74.439999999999998 110.783 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.507 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 72.6 m-70 -104.5 132.75 50.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.5 . . . . 74.340000000000003 110.833 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.6 t -86.21 11.95 10.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 75.420000000000002 110.853 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.417 ' CD2' HD11 ' A' ' 50' ' ' LEU . 25.9 p80 -140.2 154.96 47.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 74.450000000000003 110.858 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -89.52 152.36 47.17 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.67 0.747 . . . . 72.540000000000006 110.878 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.452 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.77 159.58 52.86 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.665 2.243 . . . . 71.219999999999999 112.365 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.48 85.68 2.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 44.219999999999999 110.892 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.2 mt -52.34 -18.17 1.48 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 65.420000000000002 110.918 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.6 -52.28 13.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 73.510000000000005 111.099 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -70.98 -34.96 64.94 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.666 -0.778 . . . . 51.130000000000003 112.571 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.1 tp -68.55 -42.04 78.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.802 0.334 . . . . 73.329999999999998 110.937 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.57 -40.81 97.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 64.319999999999993 110.891 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.95 -28.45 57.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.239999999999995 111.102 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.2 mt -81.59 -29.65 33.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.400000000000006 110.943 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 41.4 mtp180 -82.38 -31.63 29.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 75.450000000000003 110.901 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.09 -34.24 71.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 61.43 110.911 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -75.97 -8.49 57.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.171 -0.468 . . . . 75.209999999999994 110.833 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.402 ' HG3' ' CD2' ' A' ' 14' ' ' LEU . 3.8 mm-40 -94.81 -52.09 4.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.22 -0.445 . . . . 74.540000000000006 110.895 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.5 mtp-105 -78.06 141.05 39.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 71.140000000000001 110.906 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.533 ' CD2' ' C ' ' A' ' 87' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 72.140000000000001 110.907 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.515 -0.234 . . . . 51.43 112.515 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.4 p -129.25 97.57 4.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.924 0.392 . . . . 72.420000000000002 110.829 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 69.8 m -143.0 137.03 29.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 70.219999999999999 110.819 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.94 167.2 25.15 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.705 -0.76 . . . . 71.219999999999999 112.443 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.7 m -135.69 126.19 26.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.806 0.336 . . . . 74.329999999999998 110.878 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.0 p -136.67 144.09 43.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.177 -0.465 . . . . 75.200000000000003 110.868 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.36 19.48 42.56 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.75 -0.738 . . . . 73.140000000000001 112.426 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.455 ' O ' ' CD2' ' A' ' 8' ' ' LEU . 3.5 tt -143.48 105.42 4.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.859 0.361 . . . . 73.120000000000005 110.902 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 mmt-85 -76.53 144.04 73.17 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.614 0.721 . . . . 72.120000000000005 110.905 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.435 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 53.6 Cg_endo -69.7 -179.5 2.93 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.744 2.296 . . . . 55.100000000000001 112.314 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.514 HD22 ' CE1' ' A' ' 13' ' ' PHE . 23.7 tp -123.44 145.75 48.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 73.400000000000006 110.909 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -91.66 136.71 32.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 73.230000000000004 110.857 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.514 ' CE1' HD22 ' A' ' 11' ' ' LEU . 68.3 m-85 -136.82 169.65 17.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 73.430000000000007 110.898 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.406 HD21 ' CG ' ' A' ' 82' ' ' ARG . 12.8 mt -143.92 120.99 11.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 73.310000000000002 110.931 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -92.41 129.32 38.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 62.409999999999997 110.881 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.516 HG22 ' CE2' ' A' ' 22' ' ' PHE . 1.2 p -108.62 165.55 11.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 60.520000000000003 111.125 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.8 m -107.3 -29.74 9.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 75.140000000000001 110.862 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.3 mp -85.86 -60.43 2.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.138 -0.483 . . . . 75.219999999999999 110.882 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.45 -91.18 0.35 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.741 -0.742 . . . . 74.420000000000002 112.477 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -168.91 -113.56 0.29 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.688 -0.768 . . . . 74.420000000000002 112.468 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 ttp180 -109.85 150.86 27.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.798 0.333 . . . . 74.030000000000001 110.852 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.516 ' CE2' HG22 ' A' ' 16' ' ' THR . 3.3 m-85 -129.25 166.04 20.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 74.230000000000004 110.88 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.49 HD23 ' CG ' ' A' ' 42' ' ' TRP . 5.0 tp -133.18 113.42 12.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.171 -0.468 . . . . 71.299999999999997 110.91 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.4 t -88.06 119.53 35.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 72.030000000000001 111.164 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.526 ' CD2' ' CD1' ' A' ' 63' ' ' ILE . 4.7 t60 -155.85 132.38 10.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 75.319999999999993 110.821 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 58.19 36.72 26.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.282 -0.417 . . . . 64.5 110.851 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m 62.23 26.07 15.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 72.540000000000006 110.822 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -126.29 -178.63 4.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 74.25 110.923 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.528 ' CD1' ' CZ ' ' A' ' 45' ' ' ARG . 67.8 mt -132.75 136.19 46.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.477 . . . . 72.420000000000002 110.926 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.511 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -130.46 159.46 36.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 71.109999999999999 110.878 -179.944 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.449 ' NE ' ' HA ' ' A' ' 45' ' ' ARG . 3.0 mtt180 -113.96 136.81 52.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 75.439999999999998 110.881 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.4 tttt -61.28 108.67 0.96 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 64.519999999999996 110.892 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -81.01 -60.06 2.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.278 -0.419 . . . . 74.319999999999993 110.89 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 26.8 pttt -153.0 177.71 10.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 75.450000000000003 110.888 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -138.49 117.57 12.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.441 . . . . 64.120000000000005 111.134 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.8 91.75 4.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 75.420000000000002 111.142 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.25 -85.84 0.1 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.73 -0.748 . . . . 74.230000000000004 112.539 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -117.26 0.17 12.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.91 0.386 . . . . 74.129999999999995 110.879 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.416 ' CE ' HG23 ' A' ' 57' ' ' ILE . 55.8 mtpt -102.94 156.77 17.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 75.219999999999999 110.893 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.5 t -138.25 117.6 14.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.267 -0.424 . . . . 60.030000000000001 111.126 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.423 ' CE2' HD11 ' A' ' 57' ' ' ILE . 9.1 m-85 -82.07 146.64 29.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 74.150000000000006 110.952 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.49 ' CG ' HD23 ' A' ' 23' ' ' LEU . 71.8 m95 -137.3 159.64 41.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.13 -0.486 . . . . 75.219999999999999 110.904 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.1 ptt? -143.64 126.13 15.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 74.340000000000003 110.908 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -38.16 114.11 0.33 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.271 -0.422 . . . . 62.32 110.871 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.528 ' CZ ' ' CD1' ' A' ' 29' ' ' LEU . 20.2 ptt180 -52.64 -22.57 5.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 73.439999999999998 110.864 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.56 43.32 1.02 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 72.420000000000002 110.867 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -85.86 -35.51 20.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.456 . . . . 72.329999999999998 110.885 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.6 -9.3 27.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 71.409999999999997 111.103 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 ttm-85 -98.29 -54.7 2.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 74.239999999999995 110.864 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.3 mt -110.05 26.46 10.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 74.430000000000007 110.886 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.14 47.38 4.33 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.757 -0.735 . . . . 73.040000000000006 112.494 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.1 t -94.94 147.08 23.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.747 0.308 . . . . 72.140000000000001 110.918 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.406 ' CB ' ' NH1' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -132.07 26.65 4.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 74.439999999999998 110.857 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.0 t -78.07 109.53 12.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 73.510000000000005 110.828 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.406 ' NH1' ' CB ' ' A' ' 53' ' ' ARG . 9.7 mpt_? -103.75 158.29 16.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.329999999999998 110.915 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -149.13 161.39 42.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 75.439999999999998 111.064 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 41' ' ' TYR . 40.6 mt -127.19 121.57 57.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 55.009999999999998 111.12 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.5 p -102.58 143.71 31.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.49 . . . . 73.129999999999995 111.127 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -129.25 87.05 2.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.243 -0.435 . . . . 70.209999999999994 110.944 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.81 -82.26 1.09 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.742 -0.742 . . . . 73.349999999999994 112.509 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.435 ' CG ' ' HA ' ' A' ' 10' ' ' PRO . 3.5 m-70 -127.75 9.59 6.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.709 0.29 . . . . 65.409999999999997 110.794 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -111.68 170.49 8.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.169 -0.468 . . . . 73.510000000000005 110.896 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.526 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 5.7 tt -148.13 145.46 18.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 72.209999999999994 111.139 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -132.7 133.31 43.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 74.439999999999998 110.897 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.2 t -104.45 130.0 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.416 . . . . 73.230000000000004 111.082 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 10.4 mmt -102.46 -62.82 1.22 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 71.230000000000004 110.858 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.21 172.93 8.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.272 -0.422 . . . . 72.409999999999997 110.842 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -106.24 168.07 9.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 63.119999999999997 110.919 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.425 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 48.0 m-70 -105.19 130.98 53.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 72.319999999999993 110.899 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.9 t -88.51 11.93 15.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.208 -0.451 . . . . 53.240000000000002 110.877 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -137.48 161.0 37.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 73.439999999999998 110.827 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -97.22 151.95 37.99 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.55 0.691 . . . . 75.409999999999997 110.963 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 154.08 68.29 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.699 2.266 . . . . 74.150000000000006 112.369 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -131.36 79.67 1.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.182 -0.463 . . . . 72.010000000000005 110.845 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.6 mt -44.18 -23.43 0.1 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 74.409999999999997 110.868 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.99 -47.82 67.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.451 . . . . 61.140000000000001 111.138 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.52 -35.58 59.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.704 -0.76 . . . . 73.040000000000006 112.548 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -71.01 -35.35 72.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.727 0.299 . . . . 72.340000000000003 110.906 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -74.6 -25.05 59.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 75.530000000000001 110.879 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.93 -31.09 69.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 74.439999999999998 111.087 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.0 mt -86.39 -32.05 21.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.266 -0.424 . . . . 75.219999999999999 110.92 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.406 ' CG ' HD21 ' A' ' 14' ' ' LEU . 3.6 mtp-105 -74.71 -38.03 62.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 75.439999999999998 110.813 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.404 ' CG ' ' N ' ' A' ' 84' ' ' ARG . 1.0 OUTLIER -58.29 -42.37 86.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.254 -0.43 . . . . 74.549999999999997 110.921 -179.954 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.404 ' N ' ' CG ' ' A' ' 83' ' ' GLN . 1.1 ptm180 -67.54 -16.45 64.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 75.230000000000004 110.906 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -98.01 -72.26 0.66 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 65.400000000000006 110.861 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -88.13 130.04 35.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.101 -0.499 . . . . 74.319999999999993 110.876 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 25.1 tp . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.16 -0.473 . . . . 75.409999999999997 110.944 179.973 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.248 0 N-CA-C 112.465 -0.254 . . . . 74.439999999999998 112.465 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -153.86 149.1 27.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.861 0.363 . . . . 75.099999999999994 110.84 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.5 p -126.97 142.89 51.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.138 -0.483 . . . . 73.219999999999999 110.871 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -142.82 -156.98 6.97 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.676 -0.773 . . . . 72.209999999999994 112.418 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.1 m -113.79 27.1 9.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.871 0.367 . . . . 62.009999999999998 110.846 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.7 t -105.74 142.53 35.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 75.409999999999997 110.843 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 8' ' ' LEU . . . 52.23 -177.72 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.65 -0.786 . . . . 64.329999999999998 112.5 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.45 ' C ' ' O ' ' A' ' 7' ' ' GLY . 0.7 OUTLIER -34.28 143.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.821 0.343 . . . . 74.319999999999993 110.922 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 69.6 mtt180 -79.45 144.02 60.78 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.614 0.721 . . . . 74.540000000000006 110.849 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -167.89 0.25 Allowed 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.636 2.224 . . . . 75.140000000000001 112.317 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 13' ' ' PHE . 14.0 tp -142.91 145.16 32.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 75.430000000000007 110.95 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -90.5 139.94 30.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 61.219999999999999 110.883 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.518 ' CD1' HD11 ' A' ' 23' ' ' LEU . 68.7 m-85 -138.88 169.53 17.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.13 -0.487 . . . . 71.420000000000002 110.817 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.402 HD11 ' CG2' ' A' ' 24' ' ' VAL . 14.8 mt -142.3 162.01 36.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 75.099999999999994 110.873 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 45.4 mtp180 -128.0 149.8 50.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 73.439999999999998 110.911 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.2 p -107.04 168.13 9.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 74.430000000000007 111.135 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.8 t -82.82 -31.46 28.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 64.439999999999998 110.831 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.47 ' N ' ' CD2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -101.84 70.87 1.26 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.479 . . . . 73.540000000000006 110.929 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.413 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 37.1 91.63 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.765 -0.731 . . . . 64.200000000000003 112.504 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -173.81 153.85 18.28 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.725 -0.75 . . . . 62.119999999999997 112.504 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.7 ttm180 -131.74 137.89 48.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 72.519999999999996 110.849 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -116.88 157.8 25.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 75.120000000000005 110.841 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.518 HD11 ' CD1' ' A' ' 13' ' ' PHE . 13.6 tp -120.84 117.08 26.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 75.239999999999995 110.853 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.402 ' CG2' HD11 ' A' ' 14' ' ' LEU . 93.7 t -92.31 117.33 35.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 64.299999999999997 111.132 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.752 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 5.7 t60 -153.52 127.76 9.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.462 . . . . 74.549999999999997 110.828 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 61.23 41.63 13.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 74.200000000000003 110.884 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.4 m 54.84 35.56 24.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 64.340000000000003 110.848 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.465 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 19.1 m-85 -133.03 -176.76 4.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 62.409999999999997 110.91 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.454 ' CD1' ' CZ ' ' A' ' 45' ' ' ARG . 56.5 mt -133.66 132.66 40.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 75.219999999999999 110.951 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.517 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -128.43 169.06 14.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 74.450000000000003 110.921 -179.925 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.454 ' HB3' ' CZ ' ' A' ' 31' ' ' ARG . 2.1 mtp-105 -129.69 142.99 50.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 73.349999999999994 110.889 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -64.13 109.02 1.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 75.109999999999999 110.903 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -83.06 -55.08 4.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 73.450000000000003 110.853 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.0 pttt -153.36 -176.13 5.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 62.030000000000001 110.927 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.75 128.05 22.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 74.099999999999994 111.129 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' A' ' 38' ' ' GLU . . . -114.07 -177.12 3.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 74.510000000000005 111.053 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -42.7 95.31 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.678 -0.772 . . . . 64.019999999999996 112.449 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 36' ' ' ALA . 7.0 mp0 55.6 42.65 29.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.94 0.4 . . . . 74.099999999999994 110.873 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.443 ' HD2' ' CG2' ' A' ' 57' ' ' ILE . 39.6 mtmt -150.12 160.68 43.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.218 -0.446 . . . . 71.120000000000005 110.833 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.5 t -138.94 121.0 17.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 73.310000000000002 111.133 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -85.3 139.42 31.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 75.099999999999994 110.903 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 74.1 m95 -129.55 157.04 43.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.131 -0.486 . . . . 74.329999999999998 110.924 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 20.3 ptt? -144.07 136.25 26.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 72.409999999999997 110.819 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.4 t -46.39 114.95 0.9 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 72.140000000000001 110.832 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.454 ' CZ ' ' CD1' ' A' ' 29' ' ' LEU . 19.0 ptt180 -55.18 -21.43 13.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.118 -0.492 . . . . 73.420000000000002 110.883 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.33 36.6 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 74.019999999999996 110.892 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -80.54 -36.45 33.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 73.530000000000001 110.927 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.43 -15.33 25.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.185 -0.461 . . . . 64.400000000000006 111.046 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.5 ttm180 -98.79 -62.12 1.28 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 73.010000000000005 110.806 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.424 ' O ' ' C ' ' A' ' 51' ' ' GLY . 95.4 mt -97.28 26.84 4.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 72.299999999999997 110.939 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.02 47.72 1.03 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.753 -0.736 . . . . 70.230000000000004 112.538 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 7.6 t -95.65 148.96 21.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.771 0.32 . . . . 74.120000000000005 110.895 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 27.7 mmm180 -124.83 8.25 8.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 75.439999999999998 110.937 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.462 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 22.8 t -58.36 147.13 32.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 50.409999999999997 110.845 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 46.9 mtt180 -146.98 164.2 33.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 73.010000000000005 110.862 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.484 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -152.43 153.81 34.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 73.019999999999996 111.149 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.443 ' CG2' ' HD2' ' A' ' 39' ' ' LYS . 85.8 mt -119.25 126.22 75.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.23 -0.441 . . . . 73.230000000000004 111.058 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 49.7 p -103.05 144.69 30.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 74.450000000000003 111.144 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -133.81 87.11 2.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 73.349999999999994 110.925 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.9 -86.62 1.55 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 72.439999999999998 112.472 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.427 ' HB3' ' CD1' ' A' ' 8' ' ' LEU . 0.5 OUTLIER -128.11 -5.59 5.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.75 0.31 . . . . 72.120000000000005 110.832 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.1 mtm105 -96.4 -178.32 4.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 74.120000000000005 110.885 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.512 HD11 ' CD2' ' A' ' 25' ' ' HIS . 8.5 tt -150.63 156.44 6.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 74.430000000000007 111.156 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.484 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 1.6 ttp -143.26 144.78 32.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 72.5 110.892 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.752 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 86.3 t -102.08 148.64 7.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.227 -0.442 . . . . 74.030000000000001 111.14 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 19.1 mtm -119.23 -62.15 1.55 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 73.150000000000006 110.899 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.9 mtt85 -103.11 164.31 11.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 73.340000000000003 110.921 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.2 m -90.86 175.34 7.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 75.25 110.903 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.462 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 65.1 m-70 -112.88 134.6 54.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 74.310000000000002 110.895 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.6 m -92.0 13.42 18.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.465 . . . . 72.340000000000003 110.956 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 31.0 p80 -139.67 166.3 24.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.133 -0.485 . . . . 75.129999999999995 110.876 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -95.66 153.72 39.34 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.635 0.731 . . . . 73.030000000000001 110.963 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.465 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.74 152.7 69.48 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.73 2.286 . . . . 71.25 112.312 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -114.37 75.67 0.94 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 74.450000000000003 110.912 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.6 mt -49.56 -19.76 0.64 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.242 -0.435 . . . . 71.310000000000002 110.927 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.02 -50.01 6.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 74.409999999999997 111.073 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.76 -34.01 88.78 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.744 -0.741 . . . . 64.430000000000007 112.472 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -73.65 -44.49 56.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.823 0.344 . . . . 74.409999999999997 111.0 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.64 -26.76 68.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 71.530000000000001 110.875 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.82 -55.57 14.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 72.5 111.129 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.5 mt -46.51 -49.32 18.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 74.209999999999994 110.946 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.1 mtt-85 -58.23 -35.44 71.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 74.319999999999993 110.881 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.431 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 1.7 tp60 -75.72 -21.97 57.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 75.299999999999997 110.938 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 58.1 mtp85 -86.78 -20.3 27.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 74.549999999999997 110.91 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -82.51 -72.77 0.43 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 75.430000000000007 110.915 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.438 ' CB ' ' CZ ' ' A' ' 86' ' ' ARG . 3.9 mtp-105 -88.7 165.07 14.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 74.519999999999996 110.893 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.3 tp . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 116.167 -0.469 . . . . 74.129999999999995 110.904 -179.968 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.49 -0.244 . . . . 72.319999999999993 112.49 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.7 t -116.15 147.19 41.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.855 0.359 . . . . 62.5 110.84 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 89.9 p -118.09 165.18 14.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 72.010000000000005 110.869 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.77 -167.5 1.1 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.651 -0.785 . . . . 72.549999999999997 112.558 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.5 p -127.77 -61.31 1.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.833 0.349 . . . . 73.239999999999995 110.793 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m -94.02 80.92 4.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 74.340000000000003 110.828 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -145.88 158.77 27.78 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.747 -0.74 . . . . 72.319999999999993 112.444 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.402 ' CD1' ' HD3' ' A' ' 62' ' ' ARG . 3.5 tp -112.23 97.2 6.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.824 0.345 . . . . 73.010000000000005 110.899 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -91.46 145.18 30.84 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.553 0.692 . . . . 71.420000000000002 110.893 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.54 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 52.9 Cg_endo -69.8 -178.45 2.36 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.735 2.29 . . . . 74.239999999999995 112.354 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.528 HD23 ' CE2' ' A' ' 13' ' ' PHE . 18.0 tp -140.9 153.64 45.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 71.25 110.875 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -110.89 140.44 45.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.158 -0.474 . . . . 72.349999999999994 110.899 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.528 ' CE2' HD23 ' A' ' 11' ' ' LEU . 8.6 m-85 -137.33 172.96 12.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.474 . . . . 74.25 110.89 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.41 HD23 ' CD ' ' A' ' 85' ' ' GLU . 3.7 mt -148.04 160.23 43.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.19 -0.459 . . . . 75.150000000000006 110.906 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 -116.84 148.59 41.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 75.040000000000006 110.848 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.9 p -115.28 134.7 54.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.182 -0.463 . . . . 75.510000000000005 111.155 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.0 t -64.96 -43.56 92.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.223 -0.444 . . . . 65.319999999999993 110.832 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mt -50.14 -19.07 0.67 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 73.140000000000001 110.89 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 109.55 73.82 0.78 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.716 -0.754 . . . . 71.430000000000007 112.541 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -177.11 -179.67 47.57 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.784 -0.722 . . . . 53.200000000000003 112.502 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -131.87 148.04 52.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.784 0.326 . . . . 73.540000000000006 110.892 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -123.95 160.89 26.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 74.209999999999994 110.928 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.9 tp -122.56 118.69 28.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.205 -0.452 . . . . 74.420000000000002 110.918 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.2 t -94.79 108.22 20.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 73.310000000000002 111.166 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.469 ' CG ' HD11 ' A' ' 63' ' ' ILE . 50.1 t60 -145.12 134.14 22.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 73.299999999999997 110.86 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 59.54 33.18 22.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 71.140000000000001 110.94 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.1 m 65.3 25.39 12.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 75.340000000000003 110.854 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.539 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 15.4 m-85 -127.84 179.18 5.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 72.239999999999995 110.875 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 11.2 mt -128.37 133.14 48.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.144 -0.48 . . . . 73.239999999999995 110.931 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.505 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.1 m-85 -124.57 164.19 20.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.244 -0.435 . . . . 75.040000000000006 110.906 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.2 mtp180 -123.23 134.34 54.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 74.209999999999994 110.85 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 34.4 tttm -59.93 110.02 1.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 72.439999999999998 110.84 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -85.0 -54.08 4.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 73.319999999999993 110.916 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.412 ' CG ' ' HB2' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -146.55 171.26 15.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 75.030000000000001 110.881 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -133.39 115.01 14.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 64.030000000000001 111.125 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.408 ' O ' ' C ' ' A' ' 37' ' ' GLY . . . -89.14 -175.62 4.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 63.32 111.159 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.408 ' C ' ' O ' ' A' ' 36' ' ' ALA . . . -37.59 -72.48 0.17 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.761 -0.733 . . . . 60.219999999999999 112.444 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -125.76 39.78 3.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.945 0.402 . . . . 75.439999999999998 110.933 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.9 mtpt -145.21 167.9 21.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 75.319999999999993 110.89 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 t -138.38 126.15 28.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 72.439999999999998 111.08 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.412 ' HB2' ' CG ' ' A' ' 34' ' ' LYS . 2.7 m-85 -90.49 139.56 30.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 74.319999999999993 110.967 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -132.99 167.59 20.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 74.329999999999998 110.894 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -152.47 130.72 12.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 72.310000000000002 110.912 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.404 ' C ' ' N ' ' A' ' 46' ' ' ASP . 2.0 t -44.35 106.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 74.430000000000007 110.869 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.5 ptt85 -44.05 -23.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 75.150000000000006 110.839 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.404 ' N ' ' C ' ' A' ' 44' ' ' CYS . 2.0 m-20 -85.31 31.31 0.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 74.129999999999995 110.834 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.406 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 3.9 tm0? -82.85 -23.63 33.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 73.25 110.921 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.62 -25.84 14.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 70.5 111.081 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.36 -52.8 3.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 74.430000000000007 110.806 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.497 HD11 ' CG ' ' A' ' 71' ' ' HIS . 54.3 mt -94.39 9.43 38.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 74.400000000000006 110.91 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 46.88 32.65 6.17 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.688 -0.768 . . . . 53.420000000000002 112.537 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 36.4 t -80.7 122.23 26.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.8 0.333 . . . . 73.450000000000003 110.88 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 26.1 mmm180 -101.5 37.21 1.85 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 74.329999999999998 110.869 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.1 t -88.77 119.65 29.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 73.540000000000006 110.862 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -117.02 146.92 42.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 74.030000000000001 110.88 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.405 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -139.4 164.85 28.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 70.109999999999999 111.029 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 61.4 mt -132.0 117.39 33.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.245 -0.434 . . . . 75.530000000000001 111.174 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.7 p -102.73 144.55 30.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 73.0 111.168 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.72 109.12 3.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 71.200000000000003 110.901 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.23 -102.86 2.65 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.818 -0.706 . . . . 64.409999999999997 112.505 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.54 ' CD2' ' HA ' ' A' ' 10' ' ' PRO . 1.8 t60 -127.51 4.78 6.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.723 0.297 . . . . 74.239999999999995 110.786 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.402 ' HD3' ' CD1' ' A' ' 8' ' ' LEU . 19.4 mtm180 -110.68 -175.57 2.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 74.109999999999999 110.8 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.469 HD11 ' CG ' ' A' ' 25' ' ' HIS . 18.7 tt -150.21 157.27 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 75.310000000000002 111.11 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.405 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 3.2 ttp -134.83 141.57 46.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 65.329999999999998 110.838 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 19.3 t -111.91 138.44 40.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.454 . . . . 71.430000000000007 111.163 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.1 mtt -105.65 -56.84 2.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 73.329999999999998 110.887 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.453 ' HD3' ' N ' ' A' ' 68' ' ' SER . 0.0 OUTLIER -118.74 144.48 46.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 71.239999999999995 110.835 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.453 ' N ' ' HD3' ' A' ' 67' ' ' ARG . 14.2 t -69.25 -179.6 1.65 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.479 . . . . 74.299999999999997 110.898 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.447 ' N ' ' OG ' ' A' ' 68' ' ' SER . 20.5 m-70 -109.27 145.76 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 74.319999999999993 110.852 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.7 t -93.4 6.19 49.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 71.019999999999996 110.848 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.497 ' CG ' HD11 ' A' ' 50' ' ' LEU . 26.2 p80 -137.32 165.63 25.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 70.299999999999997 110.911 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -100.42 150.31 36.84 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.61 0.719 . . . . 75.239999999999995 110.913 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.539 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.5 Cg_endo -69.74 158.86 55.53 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.664 2.243 . . . . 63.310000000000002 112.292 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -139.81 90.54 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.472 . . . . 63.140000000000001 110.871 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.8 mt -55.82 -14.23 2.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.232 -0.44 . . . . 70.430000000000007 110.909 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.4 -49.06 58.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 72.209999999999994 111.07 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.99 -32.94 34.57 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.746 -0.74 . . . . 72.040000000000006 112.487 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -67.79 -39.93 83.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 62.219999999999999 110.925 -179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -63.4 -24.8 68.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.134 -0.484 . . . . 73.400000000000006 110.91 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.22 70.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 74.409999999999997 111.097 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 50.3 mt -63.85 -51.67 63.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 73.230000000000004 110.909 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.408 ' HG3' ' CD2' ' A' ' 14' ' ' LEU . 0.1 OUTLIER -55.72 -21.59 19.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 74.409999999999997 110.953 179.868 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.415 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 0.6 OUTLIER -78.67 -21.93 47.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.152 -0.476 . . . . 74.109999999999999 110.926 -179.914 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -81.49 -56.75 3.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 75.439999999999998 110.891 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.41 ' CD ' HD23 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -43.55 -34.15 1.32 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 74.209999999999994 110.837 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -100.47 145.03 28.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 74.310000000000002 110.823 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.7 mt . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 73.329999999999998 110.941 179.996 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 112.536 -0.226 . . . . 73.400000000000006 112.536 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.2 m -118.33 -54.83 2.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.845 0.355 . . . . 61.229999999999997 110.846 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.3 t -45.02 138.2 3.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 73.5 110.905 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.07 -170.48 46.15 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.786 -0.721 . . . . 54.409999999999997 112.456 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.7 p -100.34 109.42 21.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.904 0.383 . . . . 75.519999999999996 110.877 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.461 ' O ' ' N ' ' A' ' 8' ' ' LEU . 56.6 m -81.85 -47.19 13.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 73.329999999999998 110.817 -179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 61.43 -75.69 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.748 -0.739 . . . . 63.229999999999997 112.481 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.461 ' N ' ' O ' ' A' ' 6' ' ' SER . 1.2 pt? -129.85 147.01 51.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.753 0.311 . . . . 74.109999999999999 110.933 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -87.94 144.25 34.47 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.61 0.719 . . . . 64.230000000000004 110.841 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.507 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 53.5 Cg_endo -69.78 -164.93 0.14 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.66 2.24 . . . . 75.120000000000005 112.381 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.535 HD22 ' CZ ' ' A' ' 13' ' ' PHE . 13.5 tp -156.11 165.72 35.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.277 -0.419 . . . . 72.439999999999998 110.924 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -112.59 140.74 47.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 75.540000000000006 110.971 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.535 ' CZ ' HD22 ' A' ' 11' ' ' LEU . 70.3 m-85 -139.84 172.91 12.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 75.510000000000005 110.887 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.436 ' O ' ' NE ' ' A' ' 21' ' ' ARG . 6.3 mt -151.78 162.5 40.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.132 -0.486 . . . . 75.430000000000007 110.841 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -127.95 149.84 50.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 74.420000000000002 110.842 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.432 ' O ' ' C ' ' A' ' 17' ' ' SER . 2.9 p -106.87 156.18 18.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.45 . . . . 64.209999999999994 111.155 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 16' ' ' THR . 5.6 m -35.75 -61.42 0.47 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 62.229999999999997 110.876 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.48 ' O ' ' N ' ' A' ' 20' ' ' GLY . 0.1 OUTLIER -84.63 -175.06 5.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.077 -0.51 . . . . 75.239999999999995 110.889 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -58.98 78.84 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.699 -0.762 . . . . 61.109999999999999 112.525 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.48 ' N ' ' O ' ' A' ' 18' ' ' LEU . . . -150.3 148.96 20.73 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.74 -0.743 . . . . 74.409999999999997 112.449 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.436 ' NE ' ' O ' ' A' ' 14' ' ' LEU . 5.9 tpt180 -140.94 129.12 22.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.85 0.357 . . . . 71.420000000000002 110.88 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -105.43 160.53 15.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 73.200000000000003 110.925 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.3 tp -119.66 125.27 48.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 71.510000000000005 110.936 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.412 ' CG2' HD12 ' A' ' 14' ' ' LEU . 20.9 t -106.15 123.0 60.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 72.530000000000001 111.162 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.48 ' CG ' HD13 ' A' ' 63' ' ' ILE . 64.9 t60 -153.02 138.77 17.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.138 -0.483 . . . . 75.329999999999998 110.877 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 54.82 24.68 5.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 74.340000000000003 110.878 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m 75.24 26.63 1.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.487 . . . . 72.010000000000005 110.903 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -124.94 -176.07 3.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 74.319999999999993 110.899 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.602 ' C ' ' CD1' ' A' ' 30' ' ' TYR . 56.0 mt -128.98 147.56 50.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 71.239999999999995 110.888 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.602 ' CD1' ' C ' ' A' ' 29' ' ' LEU . 1.0 OUTLIER -144.77 173.75 11.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 75.349999999999994 110.915 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -135.59 141.91 45.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.126 -0.488 . . . . 73.549999999999997 110.887 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.2 tttm -64.35 115.51 5.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 73.239999999999995 110.882 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -92.91 -57.18 2.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 71.340000000000003 110.926 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -150.6 179.04 8.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.487 . . . . 71.019999999999996 110.951 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -136.88 117.73 14.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 74.0 111.177 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.57 -175.57 3.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 75.420000000000002 111.04 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -48.97 94.36 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.72 -0.752 . . . . 71.239999999999995 112.494 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 62.51 34.59 15.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.934 0.397 . . . . 73.230000000000004 110.887 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -145.33 158.03 43.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 74.310000000000002 110.885 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.1 t -138.25 114.17 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 75.040000000000006 111.114 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -78.69 146.07 34.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 74.319999999999993 110.914 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 69.5 m95 -135.88 151.85 50.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.079 -0.509 . . . . 72.310000000000002 110.905 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -134.93 129.82 34.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 72.409999999999997 110.895 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.6 t -42.81 116.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 74.450000000000003 110.859 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.453 ' CZ ' HD11 ' A' ' 29' ' ' LEU . 18.3 ptt180 -55.14 -20.55 10.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 74.530000000000001 110.874 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.54 36.44 0.54 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 65.0 110.854 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -88.43 -18.88 27.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.143 -0.48 . . . . 74.519999999999996 110.913 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.12 -31.05 12.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 73.010000000000005 111.144 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.0 ttm-85 -95.05 -57.36 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 71.230000000000004 110.811 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.546 HD11 ' CD2' ' A' ' 71' ' ' HIS . 22.6 mt -95.61 22.65 6.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 63.200000000000003 110.915 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.94 29.66 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.687 -0.768 . . . . 73.230000000000004 112.466 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.475 ' N ' ' O ' ' A' ' 50' ' ' LEU . 4.7 t -75.76 127.66 33.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.844 0.354 . . . . 74.209999999999994 110.852 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.33 -10.92 17.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 74.319999999999993 110.844 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 m -39.32 128.26 1.8 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.229 -0.441 . . . . 74.120000000000005 110.86 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.41 ' C ' ' HG3' ' A' ' 66' ' ' MET . 16.0 mtt85 -123.82 166.03 16.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 74.430000000000007 110.842 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -149.72 156.51 41.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 75.049999999999997 111.075 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 91.0 mt -125.42 122.49 62.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 71.109999999999999 111.121 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 34.3 p -101.1 142.43 32.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 74.319999999999993 111.128 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.95 87.17 2.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 73.129999999999995 110.95 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.45 -85.23 1.56 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.721 -0.752 . . . . 73.319999999999993 112.486 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.507 ' CG ' ' HA ' ' A' ' 10' ' ' PRO . 0.4 OUTLIER -128.89 -1.24 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.771 0.32 . . . . 63.310000000000002 110.855 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.434 ' CB ' ' CZ ' ' A' ' 62' ' ' ARG . 1.4 mtp-105 -102.71 174.39 5.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 73.120000000000005 110.888 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.48 HD13 ' CG ' ' A' ' 25' ' ' HIS . 4.9 tt -145.06 154.14 14.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 75.049999999999997 111.114 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.456 ' N ' HG12 ' A' ' 63' ' ' ILE . 9.4 ttp -138.16 142.66 40.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.149 -0.478 . . . . 75.420000000000002 110.882 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.1 t -95.14 145.03 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 74.329999999999998 111.067 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.41 ' HG3' ' C ' ' A' ' 55' ' ' ARG . 31.0 mtp -104.77 -61.04 1.51 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.088 -0.505 . . . . 74.310000000000002 110.783 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -123.02 162.65 21.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 74.109999999999999 110.888 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.34 153.91 29.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 51.229999999999997 110.86 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -92.37 137.86 32.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.099 -0.5 . . . . 75.230000000000004 110.848 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 51.9 t -89.48 10.1 24.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 72.25 110.865 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.546 ' CD2' HD11 ' A' ' 50' ' ' LEU . 31.8 p80 -136.93 142.81 42.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 73.5 110.801 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -79.8 155.59 75.49 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.587 0.708 . . . . 74.230000000000004 110.914 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.66 155.86 65.14 Favored 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.743 2.295 . . . . 74.150000000000006 112.365 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -133.14 80.37 1.88 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 70.409999999999997 110.884 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.433 HD22 ' N ' ' A' ' 75' ' ' LEU . 3.4 mt -45.78 -23.85 0.31 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.234 -0.439 . . . . 74.209999999999994 110.848 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.57 -43.18 73.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 73.319999999999993 111.088 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -77.99 -36.8 30.94 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.753 -0.737 . . . . 70.040000000000006 112.465 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tp -69.64 -37.39 76.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.741 0.305 . . . . 75.209999999999994 110.94 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -68.98 -29.44 67.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 74.140000000000001 110.904 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.63 93.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.1 -0.5 . . . . 64.120000000000005 111.102 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 61.4 mt -67.98 -46.96 69.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.23 -0.441 . . . . 73.349999999999994 110.966 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.8 mtp-105 -65.95 -20.73 66.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.791 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.44 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -75.08 -29.27 60.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 74.430000000000007 110.963 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 23.4 mtp85 -77.98 -28.23 49.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 74.430000000000007 110.874 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -62.63 -59.09 5.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 75.439999999999998 110.861 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 -108.15 90.45 3.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 70.430000000000007 110.828 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.4 pp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 74.239999999999995 110.843 -179.955 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.463 ' O ' ' N ' ' A' ' 3' ' ' SER . . . . . . . . 0 N--CA 1.452 -0.288 0 N-CA-C 112.47 -0.252 . . . . 74.409999999999997 112.47 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 1' ' ' GLY . 1.4 m 34.52 34.28 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.877 0.37 . . . . 73.310000000000002 110.884 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.463 ' N ' ' O ' ' A' ' 1' ' ' GLY . 1.9 m -61.94 -24.99 67.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.088 -0.506 . . . . 72.329999999999998 110.797 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.49 -157.63 33.87 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.766 -0.731 . . . . 63.140000000000001 112.504 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 28.5 t -155.38 127.76 7.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.822 0.344 . . . . 75.230000000000004 110.84 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.6 t -112.41 4.12 17.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 75.329999999999998 110.877 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.43 1.78 4.67 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.81 -0.71 . . . . 61.409999999999997 112.495 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.53 ' C ' ' CD1' ' A' ' 8' ' ' LEU . 0.3 OUTLIER -106.54 96.24 6.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.817 0.342 . . . . 74.329999999999998 110.88 -179.888 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.44 ' CD ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -77.78 143.92 67.87 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.571 0.7 . . . . 75.430000000000007 110.924 179.911 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.487 ' CB ' ' CE1' ' A' ' 61' ' ' HIS . 53.5 Cg_endo -69.76 -176.36 1.46 Allowed 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 122.649 2.232 . . . . 73.109999999999999 112.401 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.564 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 28.8 tp -135.93 143.28 44.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.299 -0.409 . . . . 73.230000000000004 110.951 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -98.15 147.47 24.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.463 . . . . 73.200000000000003 110.858 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.564 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 52.3 m-85 -136.68 172.86 12.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 63.049999999999997 110.874 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.0 mt -147.51 158.29 43.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 72.450000000000003 110.923 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 -124.46 128.01 48.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 74.400000000000006 110.876 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.2 p -94.46 143.7 26.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.11 -0.496 . . . . 73.540000000000006 111.209 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 58.1 m -58.31 -21.16 48.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 60.32 110.956 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -80.65 42.5 0.62 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.05 -0.523 . . . . 71.420000000000002 110.919 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 48.3 19.38 1.13 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.785 -0.722 . . . . 72.040000000000006 112.483 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -106.75 166.01 13.52 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.766 -0.73 . . . . 72.510000000000005 112.448 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.6 ttt85 -123.9 124.27 42.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.851 0.358 . . . . 74.439999999999998 110.915 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.558 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -100.99 170.73 8.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 73.0 110.855 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.442 HD11 ' CD2' ' A' ' 13' ' ' PHE . 4.3 tp -139.1 138.17 36.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 72.310000000000002 110.93 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 18.1 t -104.26 126.55 58.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 72.5 111.093 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.674 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 5.2 t60 -159.73 132.28 6.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.128 -0.487 . . . . 72.230000000000004 110.844 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 53.17 37.79 25.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 72.129999999999995 110.9 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 72.1 m 63.05 26.7 15.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 74.150000000000006 110.857 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -126.68 164.11 22.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 73.530000000000001 110.807 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.461 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 62.6 mt -115.3 137.64 51.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 72.530000000000001 110.867 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.523 ' CE1' ' HB3' ' A' ' 25' ' ' HIS . 1.6 m-85 -127.16 168.02 15.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 71.409999999999997 110.995 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.558 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 12.4 mtp-105 -128.72 118.38 22.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 72.040000000000006 110.893 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.446 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 32.8 tttm -41.57 116.6 0.79 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.444 . . . . 70.239999999999995 110.836 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -91.5 -54.34 3.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.219 -0.446 . . . . 74.099999999999994 110.906 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.91 -178.19 6.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 74.239999999999995 110.894 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.89 135.19 20.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 62.25 111.13 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -104.81 36.49 2.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 53.350000000000001 111.076 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.25 -63.27 4.45 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.722 -0.751 . . . . 74.239999999999995 112.43 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -101.75 -26.87 13.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.964 0.411 . . . . 73.430000000000007 110.866 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.9 mtmp? -105.4 159.91 15.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.483 . . . . 75.310000000000002 110.86 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.4 t -137.57 116.75 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 74.439999999999998 111.179 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.525 ' CE2' HD13 ' A' ' 57' ' ' ILE . 3.4 m-85 -80.75 145.9 31.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 73.200000000000003 110.954 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.446 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 77.1 m95 -137.29 148.7 46.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 74.010000000000005 110.874 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 12.2 ptt? -131.62 126.88 35.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 63.530000000000001 110.843 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -42.54 120.78 1.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 74.310000000000002 110.85 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.461 ' CZ ' HD13 ' A' ' 29' ' ' LEU . 19.8 ptt180 -53.02 -17.84 1.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 73.209999999999994 110.884 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -87.88 17.45 4.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 73.439999999999998 110.903 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.41 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -78.49 -15.5 58.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.227 -0.442 . . . . 74.25 110.888 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -96.76 -32.85 11.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 73.329999999999998 111.05 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -98.38 -62.51 1.23 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 74.5 110.843 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.561 HD12 ' CD2' ' A' ' 71' ' ' HIS . 31.6 mt -83.12 15.45 2.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 62.109999999999999 110.922 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.61 33.54 1.55 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.789 -0.72 . . . . 71.510000000000005 112.429 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.1 t -77.75 108.91 11.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.8 0.333 . . . . 75.140000000000001 110.92 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -84.35 12.56 6.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 74.310000000000002 110.856 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.1 t -60.22 113.41 2.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 75.450000000000003 110.874 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.6 mtm180 -119.34 137.94 53.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 75.540000000000006 110.867 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -126.6 160.43 30.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 75.239999999999995 111.132 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.525 HD13 ' CE2' ' A' ' 41' ' ' TYR . 31.6 mt -128.23 128.36 68.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 74.099999999999994 111.158 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.441 HG22 ' NE1' ' A' ' 42' ' ' TRP . 19.3 p -101.95 147.39 26.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 74.120000000000005 111.205 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -142.83 106.89 4.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 72.430000000000007 110.875 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 69.93 -92.86 0.39 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.744 -0.741 . . . . 75.010000000000005 112.51 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.487 ' CE1' ' CB ' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -128.82 6.91 5.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.772 0.32 . . . . 75.310000000000002 110.887 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 39.4 mtp85 -108.03 -175.93 2.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.287 -0.415 . . . . 75.140000000000001 110.867 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.528 HD12 ' CD2' ' A' ' 25' ' ' HIS . 9.8 tt -150.35 153.41 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 74.310000000000002 111.104 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 68.2 mtm -135.92 146.88 47.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 71.400000000000006 110.832 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.674 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 17.2 t -116.51 132.23 66.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 73.450000000000003 111.13 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mmm -92.02 -58.55 2.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 71.450000000000003 110.891 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -118.44 160.19 22.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 74.040000000000006 110.861 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.2 m -78.62 -179.71 6.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 61.100000000000001 110.76 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -108.26 139.83 42.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.105 -0.498 . . . . 62.420000000000002 110.814 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.1 t -94.52 15.91 16.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 54.140000000000001 110.922 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.561 ' CD2' HD12 ' A' ' 50' ' ' LEU . 24.3 p80 -145.25 150.89 37.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.144 -0.48 . . . . 71.530000000000001 110.826 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -81.07 152.43 71.32 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.579 0.704 . . . . 62.210000000000001 110.964 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 149.61 67.36 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.708 2.272 . . . . 73.109999999999999 112.372 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.33 81.42 1.89 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.271 -0.422 . . . . 52.119999999999997 110.837 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 34.7 mt -53.95 -23.48 13.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 73.519999999999996 110.971 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.0 -45.71 66.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 63.149999999999999 111.147 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.01 -31.38 43.41 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.728 -0.749 . . . . 53.210000000000001 112.519 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tp -70.68 -38.3 73.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.723 0.297 . . . . 74.340000000000003 110.911 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -68.55 -23.46 64.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.254 -0.43 . . . . 74.439999999999998 110.849 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.55 -44.57 86.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 73.120000000000005 111.077 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.2 mt -69.92 -50.35 42.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 75.209999999999994 110.885 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 50.3 mtp180 -60.25 -19.61 55.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 74.319999999999993 110.879 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.411 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 0.5 OUTLIER -76.76 -24.39 52.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 74.310000000000002 110.909 -179.905 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 85' ' ' GLU . 29.0 mtt180 -85.81 -35.05 20.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 75.120000000000005 110.822 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.405 ' C ' ' O ' ' A' ' 84' ' ' ARG . 1.0 OUTLIER -37.77 -44.42 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 62.100000000000001 110.924 -179.889 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.25 139.9 38.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 71.109999999999999 110.871 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.6 tp . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 73.439999999999998 110.921 179.966 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.374 0 N-CA-C 112.487 -0.245 . . . . 44.119999999999997 112.487 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.4 t -145.6 152.84 40.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.921 0.391 . . . . 74.299999999999997 110.876 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.6 t -71.6 98.85 1.96 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.14 -0.482 . . . . 74.430000000000007 110.861 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.74 157.18 15.46 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.741 -0.742 . . . . 64.530000000000001 112.454 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 41.3 t -104.4 13.41 32.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.88 0.371 . . . . 71.030000000000001 110.885 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 28.4 m -85.57 -32.06 22.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 74.209999999999994 110.924 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.53 -84.96 0.38 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.794 -0.717 . . . . 63.310000000000002 112.53 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.462 HD12 ' NE ' ' A' ' 62' ' ' ARG . 0.5 OUTLIER -172.19 176.73 3.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.812 0.339 . . . . 75.239999999999995 110.921 -179.912 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.8 mtt85 -111.53 144.0 29.66 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.638 0.733 . . . . 65.430000000000007 110.894 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 177.68 5.33 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.663 2.242 . . . . 72.329999999999998 112.304 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.51 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 24.5 tp -145.45 145.02 30.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 74.430000000000007 110.968 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 -101.24 152.87 20.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.212 -0.449 . . . . 61.109999999999999 110.942 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.51 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 61.6 m-85 -137.93 169.93 16.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 110.832 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.1 mt -145.08 165.21 28.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 71.430000000000007 110.956 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -127.8 147.85 50.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 71.329999999999998 110.899 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.443 ' OG1' ' N ' ' A' ' 20' ' ' GLY . 1.2 p -115.08 169.91 8.75 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.118 -0.492 . . . . 65.099999999999994 111.089 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 67.0 m -95.64 -51.26 4.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 73.319999999999993 110.846 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.3 mp -84.97 -44.75 12.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 74.219999999999999 110.911 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.5 -105.25 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.79 -0.719 . . . . 73.129999999999995 112.46 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.443 ' N ' ' OG1' ' A' ' 16' ' ' THR . . . -165.02 -92.15 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.779 -0.724 . . . . 63.200000000000003 112.489 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.5 tpt85 -130.64 129.31 42.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.831 0.348 . . . . 73.409999999999997 110.813 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.474 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -103.55 165.54 10.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 74.120000000000005 110.878 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.4 tp -130.4 135.13 47.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 72.040000000000006 110.946 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.499 ' CG1' ' NH2' ' A' ' 82' ' ' ARG . 68.0 t -101.85 116.92 46.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 73.329999999999998 111.072 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.596 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 10.7 t60 -152.83 127.03 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 75.420000000000002 110.874 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 59.89 43.43 14.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 72.200000000000003 110.867 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.438 ' OG ' ' CD2' ' A' ' 75' ' ' LEU . 1.4 t 56.89 20.11 5.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.122 -0.49 . . . . 74.019999999999996 110.88 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.463 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 20.1 m-85 -116.52 -177.38 3.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 74.209999999999994 110.928 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 65.8 mt -134.14 134.08 41.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 74.310000000000002 110.897 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.511 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -125.93 172.03 10.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 75.310000000000002 110.956 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.474 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 59.4 mtp180 -131.7 129.08 40.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 73.540000000000006 110.924 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.43 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 51.6 tttm -54.86 122.07 9.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 73.310000000000002 110.934 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -94.06 -54.81 3.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 64.349999999999994 110.903 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.05 164.57 37.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.5 . . . . 75.120000000000005 110.846 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.48 131.98 54.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.439 . . . . 72.450000000000003 111.096 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -101.97 37.13 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.288 -0.414 . . . . 74.319999999999993 111.12 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.98 -73.39 2.31 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.682 -0.771 . . . . 62.009999999999998 112.453 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -102.95 -11.28 18.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 73.450000000000003 110.9 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 27.5 mtmm -115.38 156.57 25.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 73.409999999999997 110.897 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.0 t -133.79 114.42 19.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 74.439999999999998 111.144 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.427 ' CE2' HD11 ' A' ' 57' ' ' ILE . 7.2 m-85 -77.74 149.06 34.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 74.310000000000002 110.967 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.43 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 77.2 m95 -139.84 165.21 27.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 75.519999999999996 110.952 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 19.4 ptt? -151.45 133.58 15.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 73.549999999999997 110.845 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.7 t -46.22 118.17 1.82 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 75.150000000000006 110.88 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 41.6 ptt85 -52.06 -23.89 5.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 74.400000000000006 110.878 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -81.98 12.34 4.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 71.430000000000007 110.788 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.415 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 5.3 tm0? -71.46 -17.45 62.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.184 -0.462 . . . . 75.150000000000006 110.931 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.15 -36.76 11.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 74.239999999999995 111.109 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.3 mtt85 -93.54 -62.75 1.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 74.239999999999995 110.886 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.504 HD12 ' CD2' ' A' ' 71' ' ' HIS . 39.7 mt -84.25 18.32 2.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.469 . . . . 72.420000000000002 110.849 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.48 38.63 0.29 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.771 -0.728 . . . . 71.209999999999994 112.497 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 32.7 t -78.2 102.32 7.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.819 0.342 . . . . 72.310000000000002 110.865 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -81.91 45.61 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 73.0 110.913 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.8 t -100.04 111.7 23.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 71.040000000000006 110.921 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -107.17 161.07 15.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 73.219999999999999 110.921 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -149.86 162.6 39.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.257 -0.428 . . . . 72.150000000000006 111.116 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.427 HD11 ' CE2' ' A' ' 41' ' ' TYR . 74.6 mt -134.26 125.34 47.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 74.219999999999999 111.151 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.2 p -101.58 150.84 22.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.451 . . . . 73.209999999999994 111.15 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -147.71 112.97 5.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 74.150000000000006 110.954 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 65.25 -92.75 0.15 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.796 -0.716 . . . . 72.420000000000002 112.558 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.46 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -128.94 2.49 5.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.811 0.338 . . . . 75.200000000000003 110.883 -179.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.462 ' NE ' HD12 ' A' ' 8' ' ' LEU . 17.1 mtt85 -102.33 -175.31 2.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 73.420000000000002 110.796 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 20.4 tt -151.0 156.35 6.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 72.519999999999996 111.118 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 49.3 mtm -136.49 149.05 47.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.451 . . . . 74.319999999999993 110.894 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.596 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 90.5 t -121.55 133.89 66.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 73.540000000000006 111.121 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.4 mtp -93.56 -63.43 1.2 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.14 -0.482 . . . . 75.549999999999997 110.834 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -112.82 167.95 10.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 74.349999999999994 110.854 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.5 m -84.99 -177.55 6.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 74.120000000000005 110.883 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -110.04 137.87 47.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 73.409999999999997 110.903 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.6 t -91.79 13.96 16.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 71.340000000000003 110.872 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.504 ' CD2' HD12 ' A' ' 50' ' ' LEU . 24.0 p80 -143.8 159.33 42.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 74.209999999999994 110.825 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -90.83 153.87 45.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.609 0.719 . . . . 73.430000000000007 110.891 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.463 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.3 Cg_endo -69.83 139.46 40.04 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.716 2.277 . . . . 73.420000000000002 112.289 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 77' ' ' GLY . 13.1 t0 -101.27 79.35 1.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 74.049999999999997 110.874 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.438 ' CD2' ' OG ' ' A' ' 27' ' ' SER . 7.9 mt -46.88 -24.64 0.62 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 73.109999999999999 110.935 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.66 -26.29 19.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 73.340000000000003 111.124 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 74' ' ' ASP . . . -84.07 -46.62 5.84 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.738 -0.744 . . . . 74.049999999999997 112.496 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.4 tp -67.71 -35.63 79.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 73.329999999999998 110.914 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -72.26 -31.44 65.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.161 -0.472 . . . . 62.340000000000003 110.952 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.72 -44.88 95.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 65.400000000000006 111.123 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.6 mt -60.18 -41.38 92.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.978 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.499 ' NH2' ' CG1' ' A' ' 24' ' ' VAL . 10.7 mtt180 -74.07 -15.29 61.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.145 -0.48 . . . . 75.439999999999998 110.901 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -80.61 -48.71 12.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 71.140000000000001 110.944 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' A' ' 85' ' ' GLU . 3.2 ptm180 -69.48 -33.14 72.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 73.530000000000001 110.95 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.419 ' C ' ' O ' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -36.65 -50.84 0.84 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 72.040000000000006 110.887 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.7 mtp180 -102.68 162.52 12.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 74.239999999999995 110.904 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.7 pt? . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 75.430000000000007 110.924 -179.959 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 112.493 -0.243 . . . . 42.109999999999999 112.493 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.7 p -53.09 156.38 2.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.864 0.364 . . . . 63.119999999999997 110.789 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.3 p -163.42 150.37 12.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 71.450000000000003 110.827 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.06 99.41 0.17 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.726 -0.75 . . . . 61.240000000000002 112.474 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.2 m -108.92 166.79 10.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.906 0.384 . . . . 75.439999999999998 110.803 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 6.5 t -87.3 7.27 29.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.072 -0.513 . . . . 74.409999999999997 110.867 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.95 39.5 1.95 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.697 -0.764 . . . . 70.420000000000002 112.535 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.427 ' CD1' ' HG3' ' A' ' 62' ' ' ARG . 0.9 OUTLIER -160.97 108.41 1.51 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.884 0.373 . . . . 75.439999999999998 110.911 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -104.77 143.99 27.82 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.627 0.727 . . . . 71.329999999999998 110.846 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.48 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 53.7 Cg_endo -69.73 -174.77 0.96 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 74.430000000000007 112.298 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.431 HD21 ' CE1' ' A' ' 13' ' ' PHE . 20.4 tp -140.44 150.85 44.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 75.5 110.944 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -105.31 148.28 27.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 71.540000000000006 110.88 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.46 ' CD1' HD13 ' A' ' 23' ' ' LEU . 28.9 m-85 -139.81 172.86 12.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.128 -0.487 . . . . 74.239999999999995 110.863 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.436 ' CD2' ' HA ' ' A' ' 82' ' ' ARG . 6.3 mt -150.65 118.51 6.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.138 -0.483 . . . . 71.239999999999995 110.926 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.5 mtp180 -98.72 138.24 36.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.040000000000006 110.832 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.2 p -114.76 164.3 14.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.462 . . . . 75.439999999999998 111.129 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.7 m -106.85 -24.1 12.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 62.130000000000003 110.88 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.5 mp -98.71 5.85 47.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.109 -0.496 . . . . 72.230000000000004 110.92 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.16 -109.37 0.47 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.8 -0.714 . . . . 75.230000000000004 112.524 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.49 -152.79 5.84 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.74 -0.743 . . . . 74.140000000000001 112.453 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.459 ' HD3' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -88.25 148.88 24.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.895 0.379 . . . . 74.409999999999997 110.825 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.459 ' N ' ' HD3' ' A' ' 21' ' ' ARG . 2.6 m-85 -126.32 157.48 38.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 73.540000000000006 110.9 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.46 HD13 ' CD1' ' A' ' 13' ' ' PHE . 15.7 tp -120.58 116.47 25.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.152 -0.476 . . . . 75.409999999999997 110.979 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.8 t -90.88 114.52 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 75.319999999999993 111.074 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.476 ' CG ' HD11 ' A' ' 63' ' ' ILE . 6.9 t60 -151.6 127.13 10.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.138 -0.483 . . . . 71.439999999999998 110.868 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 62.97 38.51 11.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 72.120000000000005 110.897 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 m 60.03 29.19 18.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.091 -0.504 . . . . 74.439999999999998 110.855 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -130.48 178.15 6.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 64.150000000000006 110.882 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.415 ' HB2' ' NH1' ' A' ' 45' ' ' ARG . 32.1 mt -130.43 132.76 45.88 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.093 -0.503 . . . . 73.200000000000003 110.883 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.523 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -127.28 167.53 16.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 73.439999999999998 110.907 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.2 mtp180 -126.96 138.92 53.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.119 -0.492 . . . . 74.420000000000002 110.856 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 25.2 tttm -59.51 116.76 4.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 75.099999999999994 110.884 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -91.63 -52.93 4.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 75.409999999999997 110.86 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.64 ' NZ ' ' CD2' ' A' ' 41' ' ' TYR . 1.8 pttm -160.53 177.84 10.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 74.239999999999995 110.862 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.33 120.02 14.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 52.43 111.026 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.27 38.16 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.481 . . . . 54.32 111.082 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 102.73 -89.13 0.7 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.728 -0.749 . . . . 74.049999999999997 112.468 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -96.72 -4.43 40.74 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.825 0.345 . . . . 72.140000000000001 110.823 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -113.7 158.61 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 73.530000000000001 110.855 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 t -136.26 119.24 22.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 72.129999999999995 111.107 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.64 ' CD2' ' NZ ' ' A' ' 34' ' ' LYS . 3.3 m-85 -81.31 151.19 28.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 71.209999999999994 110.941 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.511 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 75.4 m95 -141.49 146.32 36.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 73.530000000000001 110.912 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.7 ptt? -129.26 144.56 51.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 73.420000000000002 110.871 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -55.13 108.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.432 . . . . 70.230000000000004 110.887 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.415 ' NH1' ' HB2' ' A' ' 29' ' ' LEU . 18.9 ptt-85 -39.98 -30.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 74.329999999999998 110.9 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -77.88 51.91 0.99 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 71.319999999999993 110.849 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -75.49 -51.8 12.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.252 -0.431 . . . . 71.109999999999999 110.909 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -98.0 -13.9 20.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 64.219999999999999 111.064 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 mmt-85 -81.82 -61.15 2.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 74.109999999999999 110.906 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.47 HD13 ' CD2' ' A' ' 71' ' ' HIS . 16.3 mt -108.01 26.75 9.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 74.319999999999993 110.928 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 38.4 42.45 1.31 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.789 -0.72 . . . . 75.349999999999994 112.469 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.7 t -96.32 130.01 43.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.79 0.328 . . . . 74.340000000000003 110.88 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -111.83 17.78 19.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.474 . . . . 71.420000000000002 110.841 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.9 t -69.51 127.88 34.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 72.030000000000001 110.832 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -121.62 173.15 7.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 75.109999999999999 110.899 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.45 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -155.52 163.76 39.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.466 . . . . 75.430000000000007 111.108 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 97.7 mt -128.37 121.71 56.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 64.439999999999998 111.089 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.429 HG22 ' CD1' ' A' ' 42' ' ' TRP . 20.1 p -101.08 151.27 22.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 74.329999999999998 111.151 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.18 113.14 2.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.465 . . . . 72.129999999999995 110.866 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 73.48 -101.11 1.13 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.793 -0.718 . . . . 73.510000000000005 112.486 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.48 ' CG ' ' HA ' ' A' ' 10' ' ' PRO . 0.4 OUTLIER -127.06 7.12 6.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.736 0.303 . . . . 75.230000000000004 110.861 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.427 ' HG3' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -111.06 -175.42 2.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 75.400000000000006 110.868 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.476 HD11 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.89 162.72 3.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 73.510000000000005 111.102 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.461 ' N ' HG12 ' A' ' 63' ' ' ILE . 1.5 ttp -143.5 148.84 36.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 75.120000000000005 110.889 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.415 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 21.6 t -113.64 144.38 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.426 . . . . 74.400000000000006 111.093 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 14.3 mtp -104.67 -61.61 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 74.129999999999995 110.895 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 52.9 mtt-85 -111.44 170.73 7.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 73.409999999999997 110.892 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 80.6 p -88.88 -177.91 5.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 75.310000000000002 110.858 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -116.01 138.96 50.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.067 -0.515 . . . . 74.299999999999997 110.866 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 4.3 t -90.98 8.35 35.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 74.349999999999994 110.837 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.47 ' CD2' HD13 ' A' ' 50' ' ' LEU . 26.5 p80 -135.59 157.76 46.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 75.230000000000004 110.792 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -91.62 151.79 42.76 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.568 0.699 . . . . 74.409999999999997 110.878 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 150.24 67.73 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.682 2.255 . . . . 75.209999999999994 112.347 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.56 81.37 1.97 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.231 -0.44 . . . . 74.129999999999995 110.913 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.452 HD22 ' N ' ' A' ' 75' ' ' LEU . 6.0 mt -48.25 -28.28 2.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 71.530000000000001 110.96 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.64 77.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 71.519999999999996 111.143 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.98 -29.23 59.25 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.741 -0.742 . . . . 72.519999999999996 112.516 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.1 tp -76.72 -41.09 46.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.761 0.315 . . . . 74.230000000000004 110.914 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -75.52 -23.43 56.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 71.209999999999994 110.908 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.92 -18.4 47.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 75.109999999999999 111.067 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.0 mt -80.56 -41.48 24.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 73.5 110.884 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.436 ' HA ' ' CD2' ' A' ' 14' ' ' LEU . 14.8 mtm180 -56.47 -49.15 75.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 75.209999999999994 110.854 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.453 ' HG3' ' N ' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -51.56 -35.46 41.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 71.540000000000006 110.88 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.453 ' N ' ' HG3' ' A' ' 83' ' ' GLN . 8.8 mtt-85 -72.81 -20.73 61.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 74.230000000000004 110.834 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.448 ' O ' ' CD ' ' A' ' 85' ' ' GLU . 2.2 tp10 -102.11 -14.62 17.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 74.329999999999998 110.868 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -106.45 138.92 41.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 64.239999999999995 110.812 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 74.519999999999996 110.927 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 112.521 -0.232 . . . . 71.540000000000006 112.521 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 m -135.45 155.51 50.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.847 0.356 . . . . 73.219999999999999 110.93 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 25.4 t -120.66 -30.54 4.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 70.150000000000006 110.877 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.1 135.03 4.38 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.701 -0.762 . . . . 75.439999999999998 112.473 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.4 p -79.5 -63.59 1.38 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.882 0.372 . . . . 74.450000000000003 110.875 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 92.8 p -108.03 87.74 2.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 74.450000000000003 110.822 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 8' ' ' LEU . . . -62.92 -31.42 80.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 72.340000000000003 112.509 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.475 ' CD1' ' HG2' ' A' ' 62' ' ' ARG . 8.0 tp -35.08 96.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.836 0.351 . . . . 72.530000000000001 110.894 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.432 ' N ' ' O ' ' A' ' 7' ' ' GLY . 3.8 mmp_? -92.11 144.0 28.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.611 0.72 . . . . 75.109999999999999 110.907 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.518 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 54.1 Cg_endo -69.71 173.51 10.82 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.703 2.269 . . . . 74.129999999999995 112.3 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.5 tp -133.22 144.46 49.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 75.120000000000005 110.925 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -98.65 159.9 14.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 71.230000000000004 110.853 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -139.31 171.9 13.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.475 . . . . 73.310000000000002 110.861 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.491 ' O ' ' N ' ' A' ' 22' ' ' PHE . 11.4 mt -148.16 128.14 13.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.126 -0.488 . . . . 74.549999999999997 110.967 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.1 mtp-105 -114.28 131.91 56.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 74.319999999999993 110.875 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.3 p -101.16 167.9 9.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 73.400000000000006 111.119 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 32.4 t -90.0 -4.22 57.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 74.420000000000002 110.821 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.6 mt -86.13 11.93 10.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 74.239999999999995 110.918 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.24 34.72 40.2 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.799 -0.715 . . . . 75.109999999999999 112.437 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -136.5 155.33 22.5 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.726 -0.75 . . . . 64.230000000000004 112.441 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.0 ttm180 -108.53 164.33 12.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.86 0.362 . . . . 72.420000000000002 110.899 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.491 ' N ' ' O ' ' A' ' 14' ' ' LEU . 3.0 m-85 -143.76 158.52 43.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 75.340000000000003 110.842 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 12.8 tp -126.46 115.85 20.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 75.109999999999999 110.903 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.41 ' CG2' HD11 ' A' ' 14' ' ' LEU . 59.4 t -89.56 122.79 41.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 75.129999999999995 111.111 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.514 ' CG ' HD11 ' A' ' 63' ' ' ILE . 33.7 t60 -161.3 134.04 6.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 64.239999999999995 110.907 179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.492 ' HG2' ' CE1' ' A' ' 25' ' ' HIS . 40.4 mm-40 60.19 29.7 19.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 75.310000000000002 110.905 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.7 m 65.74 27.71 11.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 74.420000000000002 110.845 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.535 ' CE2' ' CD2' ' A' ' 69' ' ' HIS . 16.6 m-85 -126.07 -174.26 3.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 74.299999999999997 110.963 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.423 HD11 ' CZ ' ' A' ' 45' ' ' ARG . 40.7 mt -135.31 130.9 35.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.219999999999999 110.898 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.468 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 2.0 m-85 -127.42 159.42 34.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.137 -0.483 . . . . 75.239999999999995 110.922 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.474 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 3.7 mtt-85 -116.33 148.8 40.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.103 -0.499 . . . . 74.140000000000001 110.873 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 41.3 tttp -71.13 109.12 4.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 71.420000000000002 110.916 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.475 ' C ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -83.78 -59.6 2.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.432 . . . . 70.099999999999994 110.898 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -153.85 -176.37 5.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 75.329999999999998 110.884 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -137.9 119.75 15.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 71.109999999999999 111.109 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.434 ' O ' ' N ' ' A' ' 38' ' ' GLU . . . -102.41 -174.73 2.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.31 -0.404 . . . . 75.239999999999995 111.157 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -45.35 93.16 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.722 -0.752 . . . . 73.209999999999994 112.506 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 36' ' ' ALA . 22.0 mt-10 58.68 40.53 23.22 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.905 0.383 . . . . 64.0 110.926 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.5 mtmm -150.93 157.93 43.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 65.019999999999996 110.845 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.5 t -135.13 117.45 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.172 -0.467 . . . . 71.439999999999998 111.175 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -82.3 135.02 35.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 75.109999999999999 110.935 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.464 ' NE1' HG22 ' A' ' 58' ' ' THR . 75.2 m95 -123.97 161.89 24.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.125 -0.489 . . . . 75.510000000000005 110.962 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -146.12 127.18 14.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.28 -0.418 . . . . 74.200000000000003 110.897 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.5 t -41.67 112.43 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.298 -0.41 . . . . 72.120000000000005 110.88 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.474 ' HB2' ' CZ ' ' A' ' 31' ' ' ARG . 19.8 ptt180 -42.28 -46.85 4.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 65.030000000000001 110.894 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.472 ' HB2' ' CG ' ' A' ' 50' ' ' LEU . 0.1 OUTLIER -80.07 56.7 2.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.182 -0.463 . . . . 75.200000000000003 110.82 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.417 ' OE1' ' CA ' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -88.99 -38.75 14.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 75.219999999999999 110.88 -179.906 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.417 ' CA ' ' OE1' ' A' ' 47' ' ' GLN . . . -89.12 -68.97 0.74 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 74.319999999999993 111.099 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -41.64 -61.87 1.0 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.319999999999993 110.801 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.472 ' CG ' ' HB2' ' A' ' 46' ' ' ASP . 23.4 mt -77.75 -18.93 55.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 74.230000000000004 110.898 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.96 37.85 28.28 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.75 -0.738 . . . . 64.239999999999995 112.452 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.4 t -90.68 143.87 26.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.839 0.352 . . . . 63.009999999999998 110.887 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.8 mmt85 -125.54 31.49 5.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 74.439999999999998 110.906 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.7 t -88.7 137.58 32.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 64.430000000000007 110.897 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -125.63 141.87 51.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 75.329999999999998 110.938 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.46 152.11 51.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 72.099999999999994 111.095 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.51 ' CG2' ' N ' ' A' ' 58' ' ' THR . 91.8 mt -117.64 162.24 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 74.530000000000001 111.141 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.51 ' N ' ' CG2' ' A' ' 57' ' ' ILE . 43.2 p -141.0 136.89 32.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 74.200000000000003 111.211 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.404 ' HG3' ' C ' ' A' ' 58' ' ' THR . 0.0 OUTLIER -146.56 109.43 4.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 75.549999999999997 110.874 179.995 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 79.16 -101.03 1.81 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.763 -0.732 . . . . 74.329999999999998 112.45 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.518 ' CD2' ' HA ' ' A' ' 10' ' ' PRO . 1.3 t60 -128.96 9.17 5.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.735 0.302 . . . . 74.25 110.841 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.475 ' HG2' ' CD1' ' A' ' 8' ' ' LEU . 9.1 mmm180 -112.71 -179.82 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 75.510000000000005 110.826 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.514 HD11 ' CG ' ' A' ' 25' ' ' HIS . 14.4 tt -146.64 159.83 10.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 75.409999999999997 111.142 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.406 ' N ' HG12 ' A' ' 63' ' ' ILE . 36.5 mtm -139.73 152.28 46.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 73.519999999999996 110.843 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.459 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 50.3 t -119.62 139.58 46.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.219 -0.446 . . . . 72.540000000000006 111.135 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mmm -97.97 -51.79 3.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 74.319999999999993 110.868 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -128.13 172.74 10.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 72.209999999999994 110.902 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 51.0 p -87.68 -179.04 6.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 72.209999999999994 110.861 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.535 ' CD2' ' CE2' ' A' ' 28' ' ' PHE . 86.4 m-70 -111.05 136.56 49.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 65.120000000000005 110.902 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.5 p -79.45 -4.17 49.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 72.430000000000007 110.862 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.449 ' NE2' ' OD1' ' A' ' 46' ' ' ASP . 12.0 p80 -121.97 178.98 4.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 110.839 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -109.36 150.21 40.8 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.654 0.74 . . . . 54.140000000000001 110.873 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.76 155.29 66.32 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.668 2.246 . . . . 34.310000000000002 112.356 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -136.8 100.04 4.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.258 -0.428 . . . . 64.319999999999993 110.881 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mt -63.94 -21.42 66.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 73.340000000000003 110.875 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -76.51 -61.98 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 75.400000000000006 111.138 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.17 -33.49 64.92 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.763 -0.732 . . . . 74.409999999999997 112.512 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 tp -72.79 -48.1 40.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.775 0.321 . . . . 75.099999999999994 110.948 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -59.73 -29.1 67.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.451 . . . . 74.420000000000002 110.832 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.33 96.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 64.150000000000006 111.132 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 mt -75.96 -26.37 56.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.283 -0.417 . . . . 73.25 110.972 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 72.7 mtp85 -74.85 -34.17 62.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 72.540000000000006 110.905 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -58.29 -34.46 70.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 73.439999999999998 110.895 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -81.3 -3.46 52.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 72.019999999999996 110.83 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.87 -31.77 9.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 75.140000000000001 110.792 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.6 ptt-85 -88.55 8.17 29.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 73.25 110.871 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.414 ' CD2' ' C ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 75.150000000000006 110.87 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 112.497 -0.241 . . . . 73.239999999999995 112.497 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.9 p -82.73 76.13 9.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.848 0.356 . . . . 74.209999999999994 110.875 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.7 p -51.6 -51.11 58.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.091 -0.504 . . . . 71.129999999999995 110.828 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.93 -94.72 0.42 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.765 -0.731 . . . . 74.109999999999999 112.484 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 47.5 t -95.9 74.61 3.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.828 0.347 . . . . 62.520000000000003 110.851 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.4 t -55.27 123.76 14.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 74.420000000000002 110.86 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -127.71 -146.96 6.48 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.725 -0.75 . . . . 72.25 112.504 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.496 ' C ' ' CD1' ' A' ' 8' ' ' LEU . 0.3 OUTLIER -66.51 100.38 0.66 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.78 0.324 . . . . 73.310000000000002 110.875 -179.9 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 50.1 mtt180 -86.71 145.12 38.38 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.56 0.695 . . . . 74.510000000000005 110.865 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.412 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 54.0 Cg_endo -69.75 -169.89 0.36 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.679 2.252 . . . . 75.140000000000001 112.355 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.562 HD22 ' CZ ' ' A' ' 13' ' ' PHE . 33.8 tp -151.54 149.49 29.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 73.120000000000005 110.91 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -105.33 151.9 23.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.183 -0.462 . . . . 72.530000000000001 110.891 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.562 ' CZ ' HD22 ' A' ' 11' ' ' LEU . 66.4 m-85 -139.79 172.89 12.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 72.209999999999994 110.891 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.506 ' CD1' ' CG2' ' A' ' 24' ' ' VAL . 5.2 mt -147.27 156.5 42.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 65.299999999999997 110.881 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.0 tpp85 -126.03 140.58 52.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 74.409999999999997 110.806 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.44 ' OG1' ' N ' ' A' ' 20' ' ' GLY . 15.0 p -112.25 148.94 33.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.184 -0.462 . . . . 72.329999999999998 111.12 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 m -80.75 -46.63 15.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 72.209999999999994 110.886 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.1 mp -112.84 64.03 0.63 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.117 -0.492 . . . . 75.310000000000002 110.939 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 178.96 -109.31 0.26 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.684 -0.769 . . . . 64.219999999999999 112.528 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.44 ' N ' ' OG1' ' A' ' 16' ' ' THR . . . -154.33 -160.51 9.87 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.645 -0.788 . . . . 53.109999999999999 112.445 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -87.33 126.15 34.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.791 0.329 . . . . 74.109999999999999 110.864 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.436 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -99.61 167.78 10.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 74.519999999999996 110.893 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.0 tp -134.38 132.66 39.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 74.239999999999995 110.905 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.506 ' CG2' ' CD1' ' A' ' 14' ' ' LEU . 55.8 t -98.44 113.35 32.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 74.340000000000003 111.128 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.636 ' HE2' ' CG2' ' A' ' 65' ' ' VAL . 6.2 t60 -149.43 122.67 8.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 74.319999999999993 110.838 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 63.46 47.74 3.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.156 -0.474 . . . . 75.140000000000001 110.938 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.96 25.54 3.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 61.420000000000002 110.871 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.402 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 20.7 m-85 -123.28 -179.17 4.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.082 -0.508 . . . . 74.129999999999995 110.903 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 22.6 mt -131.34 139.09 49.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.186 -0.461 . . . . 74.019999999999996 110.949 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.508 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -133.16 159.64 39.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.465 . . . . 72.420000000000002 110.924 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.436 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -123.47 124.57 43.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 75.25 110.912 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -46.37 112.94 0.55 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 70.230000000000004 110.838 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -90.35 -53.38 4.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 72.030000000000001 110.885 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.3 ptmm? -161.25 -176.61 5.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -143.67 133.3 23.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.27 -0.423 . . . . 71.109999999999999 111.075 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -109.82 69.14 0.69 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 64.109999999999999 111.079 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.77 -101.08 2.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.72 -0.752 . . . . 43.240000000000002 112.533 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -101.54 1.18 37.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.87 0.367 . . . . 70.540000000000006 110.924 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -112.58 143.69 43.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.117 -0.492 . . . . 74.510000000000005 110.876 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.89 119.6 60.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 72.510000000000005 111.069 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.426 ' N ' ' CD1' ' A' ' 41' ' ' TYR . 6.5 m-30 -78.52 144.59 35.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.201 -0.454 . . . . 72.430000000000007 110.971 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -136.08 123.09 21.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 71.420000000000002 110.939 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.8 ptt? -106.84 139.75 40.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 64.129999999999995 110.894 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.0 t -54.03 115.54 2.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 73.420000000000002 110.907 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 21.7 ptt-85 -41.59 -34.54 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 75.310000000000002 110.834 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -82.82 45.49 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 72.099999999999994 110.852 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -87.28 -27.97 22.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 75.230000000000004 110.937 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.85 -25.45 15.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 64.099999999999994 111.094 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 23.7 ttm-85 -90.8 -59.97 2.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 74.310000000000002 110.87 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.442 ' O ' ' N ' ' A' ' 52' ' ' CYS . 37.8 mt -96.53 22.7 7.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.2 -0.454 . . . . 73.430000000000007 110.888 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 37.76 29.63 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.822 -0.704 . . . . 75.340000000000003 112.536 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.442 ' N ' ' O ' ' A' ' 50' ' ' LEU . 4.7 t -80.92 99.32 8.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.827 0.346 . . . . 72.010000000000005 110.871 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 30.3 mmm-85 -80.6 7.38 10.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 74.25 110.869 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.9 t -54.82 110.92 0.72 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 54.420000000000002 110.83 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -112.36 166.97 10.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 64.409999999999997 110.916 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -148.36 166.67 27.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 63.450000000000003 111.11 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.406 HG12 ' CD1' ' A' ' 41' ' ' TYR . 86.8 mt -132.47 123.58 50.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 75.340000000000003 111.063 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 49.1 p -102.91 153.5 20.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.48 . . . . 72.319999999999993 111.161 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -153.12 109.82 3.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 70.120000000000005 110.857 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 71.46 -96.73 0.65 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.703 -0.761 . . . . 72.319999999999993 112.505 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.465 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -128.07 9.17 6.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.328 . . . . 71.140000000000001 110.857 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.42 ' NH1' ' HB3' ' A' ' 62' ' ' ARG . 14.8 mtp-105 -110.99 -176.92 3.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 73.439999999999998 110.858 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.436 HD11 ' CG ' ' A' ' 25' ' ' HIS . 19.4 tt -148.03 160.58 7.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.454 . . . . 74.420000000000002 111.072 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 8.1 ttp -142.53 148.44 37.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 74.420000000000002 110.847 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.636 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 93.4 t -118.57 141.97 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 74.310000000000002 111.091 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.433 ' N ' HG13 ' A' ' 65' ' ' VAL . 9.4 mmm -105.59 -61.93 1.43 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 60.210000000000001 110.886 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.405 ' HD3' ' N ' ' A' ' 68' ' ' SER . 1.9 tmt_? -114.03 148.61 36.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 75.010000000000005 110.875 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.405 ' N ' ' HD3' ' A' ' 67' ' ' ARG . 13.7 p -68.73 -175.5 0.7 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 73.150000000000006 110.906 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -112.07 142.86 43.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 74.200000000000003 110.812 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.3 t -92.39 9.16 35.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 73.099999999999994 110.807 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.429 ' CD2' HD13 ' A' ' 50' ' ' LEU . 28.5 p80 -138.97 161.3 37.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 71.019999999999996 110.835 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -94.23 155.43 39.93 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.609 0.718 . . . . 73.420000000000002 110.945 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.402 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 54.1 Cg_endo -69.82 155.55 65.43 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.709 2.273 . . . . 71.299999999999997 112.32 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -134.46 80.25 1.84 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 73.25 110.83 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -46.57 -24.16 0.49 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 75.209999999999994 110.947 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.53 -50.97 32.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.143 -0.481 . . . . 74.310000000000002 111.131 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.32 -37.88 80.62 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.679 -0.772 . . . . 64.140000000000001 112.473 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.0 tp -69.7 -41.8 74.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.779 0.323 . . . . 72.209999999999994 110.918 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -60.96 -23.3 65.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.137 -0.483 . . . . 70.340000000000003 110.845 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.75 -60.56 2.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 53.210000000000001 111.065 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.2 mt -52.86 -45.92 67.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 71.439999999999998 110.948 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 36.4 mtp180 -64.42 -24.3 67.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.46 . . . . 71.239999999999995 110.907 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -85.0 -31.8 23.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 72.239999999999995 110.917 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -72.49 -18.64 61.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 74.109999999999999 110.838 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -77.85 -35.94 50.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 75.530000000000001 110.945 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -90.57 52.52 2.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.115 -0.493 . . . . 73.310000000000002 110.836 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 116.209 -0.45 . . . . 73.230000000000004 110.94 179.99 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 112.425 -0.27 . . . . 72.120000000000005 112.425 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.2 p -124.87 130.19 51.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.902 0.382 . . . . 75.5 110.822 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 m -134.55 177.29 7.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.086 -0.506 . . . . 75.319999999999993 110.934 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.39 -167.2 22.46 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.707 -0.758 . . . . 73.310000000000002 112.464 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.6 m -92.39 161.79 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.922 0.392 . . . . 65.430000000000007 110.857 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.3 m -105.73 17.09 24.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 74.120000000000005 110.916 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.81 -51.21 2.7 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.755 -0.736 . . . . 75.439999999999998 112.557 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 15.2 tp -76.7 92.52 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.811 0.338 . . . . 70.310000000000002 110.928 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -82.09 144.0 50.18 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.687 0.756 . . . . 74.150000000000006 110.79 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.441 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 54.0 Cg_endo -69.76 -171.06 0.43 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.633 2.222 . . . . 72.549999999999997 112.37 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.557 HD23 ' CE2' ' A' ' 13' ' ' PHE . 15.4 tp -148.92 151.98 35.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.212 -0.449 . . . . 75.310000000000002 110.923 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -105.41 141.52 36.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 72.219999999999999 110.87 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.557 ' CE2' HD23 ' A' ' 11' ' ' LEU . 19.7 m-85 -139.36 170.18 16.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 75.420000000000002 110.921 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 mt -143.72 146.59 33.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.155 -0.475 . . . . 72.030000000000001 110.888 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 62.0 mtp85 -121.74 114.16 20.71 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 74.400000000000006 110.909 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -122.24 138.18 54.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.273 -0.422 . . . . 73.420000000000002 111.143 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.7 t -46.98 -57.93 4.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 75.329999999999998 110.831 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.402 ' N ' ' CD2' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -86.33 145.03 27.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 75.420000000000002 110.921 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.94 -30.96 4.12 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.776 -0.726 . . . . 51.130000000000003 112.518 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 103.23 -128.04 9.39 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.747 -0.74 . . . . 60.350000000000001 112.476 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 -103.43 156.39 17.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.812 0.339 . . . . 75.219999999999999 110.909 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -129.69 158.81 38.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 75.420000000000002 110.873 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.479 HD11 ' CD2' ' A' ' 13' ' ' PHE . 11.2 tp -122.22 115.34 22.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.194 -0.457 . . . . 65.319999999999993 110.908 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.5 t -89.95 116.33 31.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 74.010000000000005 111.158 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.622 ' HE2' HG21 ' A' ' 65' ' ' VAL . 14.3 t60 -153.97 129.25 9.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 71.530000000000001 110.889 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 62.66 37.76 12.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 74.409999999999997 110.904 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m 60.19 26.1 15.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 51.140000000000001 110.901 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.468 ' CE1' ' CE1' ' A' ' 71' ' ' HIS . 13.4 m-85 -126.82 -176.82 3.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 75.329999999999998 110.859 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.421 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 14.7 mt -134.33 134.25 41.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 64.540000000000006 110.915 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.508 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.1 m-85 -129.16 169.16 15.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.249 -0.432 . . . . 74.540000000000006 110.99 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -129.32 138.01 51.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 74.409999999999997 110.869 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.478 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 38.3 tttt -61.88 113.33 2.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 73.349999999999994 110.911 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -88.62 -47.56 8.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 74.430000000000007 110.909 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -157.28 169.27 25.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 74.140000000000001 110.906 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.72 123.14 23.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 73.0 111.152 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.3 34.73 1.39 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.449 . . . . 71.349999999999994 111.12 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.64 -88.7 0.94 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.708 -0.758 . . . . 70.150000000000006 112.537 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -92.29 -0.22 57.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.891 0.377 . . . . 63.329999999999998 110.883 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -121.6 157.78 30.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 75.340000000000003 110.837 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.455 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 2.5 t -138.46 112.9 8.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.236 -0.438 . . . . 75.25 111.123 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -77.11 139.3 39.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.114 -0.493 . . . . 71.109999999999999 110.978 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.478 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 81.6 m95 -128.48 165.98 19.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.148 -0.478 . . . . 73.209999999999994 110.889 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -151.84 140.68 20.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 73.530000000000001 110.919 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.0 t -51.06 106.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 73.430000000000007 110.872 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.421 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.3 ptt-85 -40.17 -33.63 0.25 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 72.409999999999997 110.844 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.97 52.35 0.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 65.519999999999996 110.874 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -73.12 -50.83 20.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.232 -0.44 . . . . 71.519999999999996 110.886 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.19 -10.01 26.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 75.120000000000005 111.028 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.3 ttt180 -84.03 -60.34 2.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 74.519999999999996 110.847 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 52' ' ' CYS . 94.3 mt -106.78 25.62 11.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.187 -0.461 . . . . 75.420000000000002 110.956 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.73 23.25 0.18 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.754 -0.736 . . . . 73.219999999999999 112.528 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 50' ' ' LEU . 6.1 t -77.46 141.44 39.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.791 0.329 . . . . 72.019999999999996 110.861 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.13 22.32 9.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 74.439999999999998 110.861 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.521 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 47.8 t -66.42 135.45 54.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 74.349999999999994 110.843 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 -128.72 160.5 32.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.086 -0.506 . . . . 75.400000000000006 110.839 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -154.86 150.3 27.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 50.32 111.067 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 51.5 mt -120.38 131.61 72.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.446 . . . . 74.340000000000003 111.152 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 36.6 p -108.88 144.5 36.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 74.040000000000006 111.134 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -134.06 87.09 2.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.241 -0.436 . . . . 75.219999999999999 110.947 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.45 -87.07 1.55 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.753 -0.737 . . . . 74.25 112.413 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.496 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -126.25 -10.76 6.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.755 0.312 . . . . 70.340000000000003 110.871 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 51.8 mtm180 -92.4 -179.96 5.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.452 . . . . 74.420000000000002 110.951 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.522 HD11 ' CD2' ' A' ' 25' ' ' HIS . 19.8 tt -150.92 158.91 4.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 75.540000000000006 111.151 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 2.4 ttp -144.14 142.01 30.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 62.229999999999997 110.882 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.622 HG21 ' HE2' ' A' ' 25' ' ' HIS . 23.0 t -102.53 140.75 20.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 71.540000000000006 111.132 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 26.3 mmm -113.35 -64.12 1.35 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.506 . . . . 73.439999999999998 110.917 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -101.58 137.29 40.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 73.219999999999999 110.912 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 85.2 p -69.29 177.83 2.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 64.230000000000004 110.86 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.521 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 47.4 m-70 -111.52 145.74 38.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.102 -0.499 . . . . 72.319999999999993 110.886 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 8.6 t -97.44 13.78 28.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 70.120000000000005 110.955 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.468 ' CE1' ' CE1' ' A' ' 28' ' ' PHE . 28.3 p80 -140.67 178.87 7.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.497 . . . . 74.209999999999994 110.833 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -111.46 152.2 43.78 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.589 0.709 . . . . 74.329999999999998 110.878 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.459 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.77 157.31 60.8 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.654 2.236 . . . . 64.400000000000006 112.328 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -135.93 83.64 2.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 75.349999999999994 110.841 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 12.6 mt -47.42 -29.54 2.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.227 -0.442 . . . . 74.209999999999994 110.901 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.96 -51.15 50.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.49 . . . . 61.439999999999998 111.162 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.65 -41.77 98.94 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.747 -0.739 . . . . 41.25 112.457 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tp -68.56 -51.51 41.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.793 0.33 . . . . 74.299999999999997 110.924 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -50.61 -22.59 2.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.439999999999998 110.858 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.414 ' O ' ' C ' ' A' ' 81' ' ' LEU . . . -69.55 -67.81 0.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 74.420000000000002 111.06 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.414 ' C ' ' O ' ' A' ' 80' ' ' ALA . 6.6 mt -37.4 -52.31 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 73.010000000000005 110.904 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -52.5 -56.58 14.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.453 . . . . 74.519999999999996 110.848 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.445 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 0.6 OUTLIER -66.62 -19.18 65.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 74.329999999999998 110.956 -179.914 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 16.7 mtt85 -86.14 -27.88 24.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 74.319999999999993 110.834 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -69.75 -40.56 76.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 73.400000000000006 110.865 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -122.89 169.61 10.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 75.430000000000007 110.909 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 24.3 tp . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 74.430000000000007 110.917 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 112.501 -0.24 . . . . 32.219999999999999 112.501 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.6 t -151.05 120.28 6.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.9 0.381 . . . . 73.409999999999997 110.936 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.5 t -69.12 102.73 1.72 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 72.129999999999995 110.852 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -38.55 135.91 1.13 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.811 -0.709 . . . . 72.310000000000002 112.453 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.5 t -96.96 134.93 39.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.858 0.361 . . . . 61.310000000000002 110.921 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.1 t -92.34 2.44 56.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 74.409999999999997 110.83 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 157.31 -116.42 0.72 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.753 -0.736 . . . . 71.430000000000007 112.506 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.49 ' CD1' ' O ' ' A' ' 9' ' ' ARG . 0.5 OUTLIER -153.97 133.53 12.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.794 0.33 . . . . 70.510000000000005 110.973 -179.997 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.49 ' O ' ' CD1' ' A' ' 8' ' ' LEU . 61.0 mtp85 -66.68 143.77 98.28 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.581 0.705 . . . . 75.140000000000001 110.87 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.412 ' HB3' ' NE2' ' A' ' 61' ' ' HIS . 53.3 Cg_endo -69.82 -170.78 0.42 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.687 2.258 . . . . 74.239999999999995 112.312 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.552 HD22 ' CZ ' ' A' ' 13' ' ' PHE . 27.9 tp -130.62 143.88 51.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 74.439999999999998 110.909 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -88.06 134.4 33.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 74.120000000000005 110.915 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.552 ' CZ ' HD22 ' A' ' 11' ' ' LEU . 64.2 m-85 -133.56 172.87 12.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.123 -0.49 . . . . 74.420000000000002 110.886 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.423 ' CD1' ' CG2' ' A' ' 24' ' ' VAL . 10.9 mt -146.82 150.26 34.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.158 -0.474 . . . . 72.129999999999995 110.891 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 -127.54 116.44 20.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.466 . . . . 73.230000000000004 110.838 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.509 HG23 ' CD2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -122.14 150.34 42.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.165 -0.471 . . . . 64.140000000000001 111.168 -179.938 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.8 t -80.8 -52.71 7.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 70.200000000000003 110.885 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.3 mt -80.95 67.66 6.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 75.099999999999994 110.873 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 159.02 -54.58 0.36 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.732 -0.747 . . . . 73.420000000000002 112.456 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 132.44 -128.53 5.23 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.722 -0.751 . . . . 74.120000000000005 112.492 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 tpp85 -106.07 136.26 46.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.898 0.38 . . . . 73.129999999999995 110.83 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.509 ' CD2' HG23 ' A' ' 16' ' ' THR . 2.7 m-85 -117.01 158.19 24.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 75.510000000000005 110.943 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.471 HD11 ' CD1' ' A' ' 13' ' ' PHE . 13.7 tp -124.88 115.99 21.51 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 75.129999999999995 110.939 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.423 ' CG2' ' CD1' ' A' ' 14' ' ' LEU . 41.4 t -90.62 113.53 26.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 72.219999999999999 111.107 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.478 ' CG ' HD13 ' A' ' 63' ' ' ILE . 15.3 t60 -148.43 124.51 10.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 73.129999999999995 110.868 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 62.73 44.37 6.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 74.099999999999994 110.87 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.6 m 55.79 25.27 8.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 62.530000000000001 110.793 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -125.99 172.93 9.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 74.129999999999995 110.86 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 33.5 mt -125.94 134.45 51.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 64.209999999999994 110.92 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.49 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.6 m-85 -127.75 167.3 16.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 74.400000000000006 110.912 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -132.6 133.37 43.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 75.439999999999998 110.903 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.533 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 73.5 tttt -55.81 114.92 2.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.246 -0.434 . . . . 74.340000000000003 110.935 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -88.88 -57.22 2.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 73.329999999999998 110.842 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.508 ' HD2' ' CG ' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -151.45 -177.69 6.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 74.099999999999994 110.85 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -132.92 138.92 47.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.461 . . . . 74.450000000000003 111.124 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -110.72 35.98 3.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 61.310000000000002 111.107 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.1 -78.59 0.52 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.843 -0.694 . . . . 72.120000000000005 112.466 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -105.02 -20.4 13.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.91 0.386 . . . . 74.150000000000006 110.875 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -98.98 163.94 12.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.197 -0.456 . . . . 74.140000000000001 110.902 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.0 t -134.32 120.68 34.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 74.409999999999997 111.104 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.508 ' CG ' ' HD2' ' A' ' 34' ' ' LYS . 2.9 m-85 -79.34 142.26 36.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 75.530000000000001 110.878 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.533 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 80.6 m95 -134.93 150.69 50.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 72.530000000000001 110.905 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -133.06 138.03 46.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 73.530000000000001 110.876 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.403 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.9 t -51.3 104.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 62.539999999999999 110.895 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -40.47 -28.4 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 74.109999999999999 110.829 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 44' ' ' CYS . 2.9 m-20 -87.86 48.49 1.65 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.248 -0.433 . . . . 71.439999999999998 110.882 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -83.3 -40.45 19.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.198 -0.456 . . . . 75.319999999999993 110.892 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.37 -9.55 38.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 74.129999999999995 111.071 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -97.33 -55.26 2.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 73.510000000000005 110.838 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.436 ' O ' ' C ' ' A' ' 51' ' ' GLY . 28.4 mt -106.69 26.9 9.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 75.200000000000003 110.938 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.436 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.62 56.13 0.78 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.677 -0.773 . . . . 71.329999999999998 112.529 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.6 t -126.47 118.34 24.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.835 0.35 . . . . 54.119999999999997 110.893 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.9 mmt-85 -93.44 2.74 56.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.205 -0.452 . . . . 74.420000000000002 110.874 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.468 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 37.8 t -40.82 105.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 72.109999999999999 110.871 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -102.93 -179.74 4.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 74.099999999999994 110.878 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.476 ' CB ' ' O ' ' A' ' 64' ' ' MET . . . -162.62 167.04 23.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 74.319999999999993 111.15 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 57.8 mt -131.52 123.89 53.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.287 -0.415 . . . . 73.200000000000003 111.11 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.446 HG22 ' NE1' ' A' ' 42' ' ' TRP . 31.3 p -108.92 141.19 41.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 75.310000000000002 111.133 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -147.24 111.54 5.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 71.409999999999997 110.886 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.73 -102.42 2.35 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.823 -0.704 . . . . 63.240000000000002 112.507 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.463 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.7 OUTLIER -129.0 10.35 5.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.786 0.327 . . . . 74.0 110.87 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -113.27 -174.99 2.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 74.420000000000002 110.893 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.478 HD13 ' CG ' ' A' ' 25' ' ' HIS . 18.5 tt -150.02 152.8 11.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 72.349999999999994 111.117 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.476 ' O ' ' CB ' ' A' ' 56' ' ' ALA . 21.4 mtm -134.52 148.77 50.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 70.200000000000003 110.878 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.454 HG22 ' HE2' ' A' ' 25' ' ' HIS . 87.3 t -117.23 138.21 48.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 64.049999999999997 111.093 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 11.2 mtp -107.96 -54.69 2.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.485 . . . . 74.040000000000006 110.923 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.74 160.52 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 64.510000000000005 110.898 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 p -95.75 167.04 11.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 74.519999999999996 110.844 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.468 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 38.0 m-70 -104.07 129.97 51.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 74.450000000000003 110.82 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.0 t -89.06 13.11 13.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.163 -0.471 . . . . 75.140000000000001 110.868 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . 0.424 ' CG ' HD12 ' A' ' 50' ' ' LEU . 19.1 p80 -133.34 172.79 12.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 75.430000000000007 110.837 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -104.65 151.41 39.27 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.711 . . . . 75.340000000000003 110.926 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 151.6 69.06 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.666 2.244 . . . . 73.239999999999995 112.303 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -112.7 81.76 1.54 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.189 -0.46 . . . . 54.109999999999999 110.834 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.9 mt -51.33 -17.69 0.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 73.519999999999996 110.857 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.86 -55.1 3.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 73.019999999999996 111.12 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.99 -37.52 91.59 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.717 -0.754 . . . . 65.549999999999997 112.526 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 12.6 tp -68.87 -51.01 44.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.779 0.323 . . . . 73.409999999999997 110.946 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -53.34 -30.93 41.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 75.200000000000003 110.87 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.05 -28.54 66.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 73.049999999999997 111.09 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mt -79.2 -39.02 34.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 74.030000000000001 110.885 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.417 ' CB ' ' CZ ' ' A' ' 82' ' ' ARG . 4.0 mtp-105 -72.88 -42.68 63.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 72.510000000000005 110.847 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.472 ' CG ' ' N ' ' A' ' 84' ' ' ARG . 2.4 pt20 -60.1 -46.37 89.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 72.310000000000002 110.9 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.472 ' N ' ' CG ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -67.99 -32.28 72.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.25 -0.432 . . . . 75.129999999999995 110.863 -179.901 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 84' ' ' ARG . 0.9 OUTLIER -34.46 -48.79 0.37 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 74.150000000000006 110.885 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 65.2 mtp180 -87.14 154.48 20.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 74.120000000000005 110.824 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 8.2 mp . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 75.0 110.904 -179.975 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.364 0 N-CA-C 112.552 -0.219 . . . . 55.420000000000002 112.552 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 t -50.5 95.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.93 0.395 . . . . 71.549999999999997 110.802 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m -121.11 161.33 21.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 54.32 110.858 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 177.43 177.57 46.39 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.687 -0.768 . . . . 52.530000000000001 112.477 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.6 t -98.04 -34.99 10.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.945 0.402 . . . . 75.150000000000006 110.883 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.8 p -110.14 97.3 6.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 73.099999999999994 110.859 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 174.88 -122.1 0.86 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.75 -0.738 . . . . 73.230000000000004 112.502 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.436 ' HB2' ' NE ' ' A' ' 62' ' ' ARG . 0.5 OUTLIER -124.99 174.46 7.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.775 0.321 . . . . 75.450000000000003 110.971 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.468 ' CG ' ' HD2' ' A' ' 10' ' ' PRO . 16.1 ttm180 -106.14 143.23 26.51 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.603 0.716 . . . . 75.0 110.913 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.468 ' HD2' ' CG ' ' A' ' 9' ' ' ARG . 54.5 Cg_endo -69.75 -170.04 0.37 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.619 2.213 . . . . 71.400000000000006 112.417 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.471 ' H ' ' CE1' ' A' ' 61' ' ' HIS . 11.8 tp -151.27 147.81 27.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 75.430000000000007 110.872 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' A' ' 13' ' ' PHE . 8.1 tp10 -103.56 146.57 28.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 74.230000000000004 110.958 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.413 ' N ' ' HG3' ' A' ' 12' ' ' GLU . 25.7 m-85 -139.44 172.93 12.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 74.230000000000004 110.84 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.433 HD11 ' CG2' ' A' ' 24' ' ' VAL . 8.9 mt -142.06 157.68 44.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 73.040000000000006 110.905 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.43 ' N ' ' HD2' ' A' ' 15' ' ' ARG . 2.5 mpt_? -125.3 119.55 28.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 73.099999999999994 110.849 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.65 132.83 54.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 70.0 111.128 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.9 m -64.73 -24.77 67.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 54.549999999999997 110.859 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.556 ' N ' ' CD2' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -114.82 81.04 1.5 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 63.340000000000003 110.927 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 149.72 -24.95 1.18 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.758 -0.734 . . . . 74.120000000000005 112.484 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.51 -96.95 1.32 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.76 -0.733 . . . . 65.409999999999997 112.493 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -134.73 137.78 43.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.817 0.341 . . . . 71.239999999999995 110.892 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -112.55 159.75 18.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.29 -0.414 . . . . 74.129999999999995 110.927 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.7 tp -131.96 130.72 41.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 73.299999999999997 110.953 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.433 ' CG2' HD11 ' A' ' 14' ' ' LEU . 97.7 t -97.1 111.43 27.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 60.020000000000003 111.137 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.546 ' CD2' ' CD1' ' A' ' 63' ' ' ILE . 2.3 t60 -148.05 129.55 14.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.429 . . . . 75.299999999999997 110.855 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 59.88 38.59 21.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 73.140000000000001 110.892 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 m 61.22 18.29 9.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.484 . . . . 73.310000000000002 110.863 -179.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -116.71 179.53 3.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 70.209999999999994 110.85 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 27.9 mt -130.37 135.4 48.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 74.140000000000001 110.886 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.499 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.2 m-85 -128.37 163.01 25.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.278 -0.419 . . . . 74.25 110.911 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.4 mtt180 -117.48 126.55 52.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 75.540000000000006 110.808 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.509 ' HB2' ' CZ3' ' A' ' 42' ' ' TRP . 54.2 tttt -54.55 110.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 74.450000000000003 110.882 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.429 ' C ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -81.38 -58.63 2.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 74.140000000000001 110.934 179.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.83 -177.57 5.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 75.150000000000006 110.884 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -141.03 109.31 5.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 65.420000000000002 111.13 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.61 90.31 7.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 71.329999999999998 111.083 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 58.35 -92.89 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.737 -0.744 . . . . 74.430000000000007 112.505 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.446 ' CD ' ' N ' ' A' ' 38' ' ' GLU . 9.1 mp0 -106.99 9.97 30.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 74.109999999999999 110.871 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.5 mtmt -116.48 155.76 28.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 72.109999999999999 110.96 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 15.4 t -134.51 122.6 40.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.313 -0.403 . . . . 74.129999999999995 111.139 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -87.18 141.8 28.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.465 . . . . 70.540000000000006 110.851 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' TRP . . . . . 0.509 ' CZ3' ' HB2' ' A' ' 32' ' ' LYS . 67.5 m95 -135.29 163.38 30.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.082 -0.508 . . . . 75.299999999999997 110.94 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 12.3 ptt? -150.17 140.36 22.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.3 -0.409 . . . . 74.319999999999993 110.919 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -52.85 107.58 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 73.120000000000005 110.889 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.1 ptt-85 -40.23 -31.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 75.219999999999999 110.947 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -81.96 43.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 75.409999999999997 110.888 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -85.33 -34.93 21.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.209 -0.45 . . . . 72.25 110.866 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -96.24 -14.97 22.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 63.420000000000002 111.035 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -97.04 -58.72 1.95 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.271 -0.422 . . . . 73.109999999999999 110.901 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.0 mt -99.49 21.9 11.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 75.209999999999994 110.926 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.56 37.82 1.97 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.764 -0.732 . . . . 73.310000000000002 112.43 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 30.9 t -93.87 110.42 22.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.82 0.343 . . . . 70.230000000000004 110.838 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.414 ' O ' ' CD ' ' A' ' 55' ' ' ARG . 0.9 OUTLIER -91.94 19.38 6.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 74.010000000000005 110.893 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.5 t -63.09 108.49 1.25 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 73.510000000000005 110.92 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.414 ' CD ' ' O ' ' A' ' 53' ' ' ARG . 1.1 mpt_? -107.06 156.4 18.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 75.450000000000003 110.888 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.8 167.68 21.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 111.117 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.452 ' CD1' ' HE2' ' A' ' 64' ' ' MET . 55.2 mt -141.57 123.42 13.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.192 -0.458 . . . . 71.0 111.104 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.452 HG22 ' NE1' ' A' ' 42' ' ' TRP . 18.4 p -109.33 149.94 28.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.113 -0.494 . . . . 71.439999999999998 111.149 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.47 89.06 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 72.5 110.867 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 86.61 -87.56 1.56 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.733 -0.746 . . . . 73.450000000000003 112.477 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . 0.471 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER -126.5 -8.19 6.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.817 0.341 . . . . 72.109999999999999 110.898 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.436 ' NE ' ' HB2' ' A' ' 8' ' ' LEU . 21.6 mtt180 -91.4 -177.4 4.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 73.140000000000001 110.855 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.546 ' CD1' ' CD2' ' A' ' 25' ' ' HIS . 5.9 tt -150.49 153.8 9.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 74.430000000000007 111.122 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 0.452 ' HE2' ' CD1' ' A' ' 57' ' ' ILE . 3.6 tmm? -138.87 151.52 47.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 75.200000000000003 110.85 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.516 ' CG2' ' HE2' ' A' ' 25' ' ' HIS . 77.7 t -111.58 134.07 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 75.230000000000004 111.173 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 13.0 mtm -103.26 -36.03 8.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 74.319999999999993 110.871 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -140.05 160.18 40.51 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.245 -0.434 . . . . 75.150000000000006 110.899 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.2 m -86.11 -179.52 6.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.186 -0.461 . . . . 74.010000000000005 110.826 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 70.6 m-70 -113.15 137.44 51.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 71.420000000000002 110.844 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.8 t -94.24 14.27 20.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 74.329999999999998 110.883 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -140.69 173.6 11.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 71.430000000000007 110.822 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -106.34 152.29 40.5 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.589 0.709 . . . . 62.039999999999999 110.832 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 167.02 25.71 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.719 2.279 . . . . 74.450000000000003 112.358 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -144.35 82.93 1.71 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.28 -0.418 . . . . 72.430000000000007 110.866 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.1 mt -47.03 -25.47 0.83 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 75.230000000000004 110.895 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.25 -42.52 83.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.049999999999997 111.102 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.61 -38.31 21.0 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.777 -0.725 . . . . 72.120000000000005 112.468 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tp -67.64 -41.45 83.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.75 0.309 . . . . 74.25 110.915 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -63.81 -25.56 68.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.192 -0.458 . . . . 75.200000000000003 110.906 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.39 -51.6 59.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 61.210000000000001 111.138 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.18 -30.78 71.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 74.329999999999998 110.869 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mtp-105 -81.23 -20.78 40.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.446 . . . . 62.240000000000002 110.92 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.16 -32.97 59.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 73.430000000000007 110.937 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -86.56 -7.74 58.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 72.200000000000003 110.885 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -108.92 -12.78 14.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.198 -0.455 . . . . 73.200000000000003 110.896 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.402 ' O ' ' CZ ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -94.18 17.75 12.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 75.230000000000004 110.89 -179.942 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.419 ' C ' HD11 ' A' ' 87' ' ' LEU . 2.3 tm? . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 75.049999999999997 110.932 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.485 HD21 HD11 ' A' ' 23' ' ' LEU . 16.4 tp . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.799 0.333 . . . . 52.420000000000002 110.888 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -106.19 150.24 26.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 61.130000000000003 110.875 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -137.81 172.47 12.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 71.129999999999995 110.807 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.43 HD21 ' CG ' ' A' ' 82' ' ' ARG . 8.5 mt -142.11 157.53 44.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.065 -0.516 . . . . 63.43 110.883 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 64.209999999999994 110.875 179.887 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.836 0.351 . . . . 63.240000000000002 110.904 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -99.49 167.88 10.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 73.129999999999995 110.927 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.485 HD11 HD21 ' A' ' 11' ' ' LEU . 10.0 tp -129.43 125.98 37.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 73.040000000000006 110.951 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.578 HG11 ' NH2' ' A' ' 82' ' ' ARG . 77.6 t -95.38 116.57 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 64.230000000000004 111.119 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.801 ' CG ' HD13 ' A' ' 63' ' ' ILE . 9.0 t60 -154.77 126.08 7.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 72.439999999999998 110.902 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 63.89 38.51 8.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 73.420000000000002 110.847 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.1 m 58.55 24.61 12.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 71.239999999999995 110.858 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -121.52 -177.3 3.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.115 -0.493 . . . . 74.019999999999996 110.887 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.574 HD12 ' HE ' ' A' ' 45' ' ' ARG . 69.8 mt -132.76 132.98 42.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.093 -0.503 . . . . 45.409999999999997 110.935 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.499 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -127.63 170.07 13.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.175 -0.466 . . . . 73.450000000000003 110.888 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.452 ' NE ' ' HB2' ' A' ' 45' ' ' ARG . 20.3 mtt180 -131.18 137.09 48.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 55.43 110.83 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.45 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 37.6 tttt -64.42 110.52 2.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 62.450000000000003 110.9 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -82.66 -59.25 2.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 63.420000000000002 110.888 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.484 ' HE2' ' CD2' ' A' ' 41' ' ' TYR . 10.1 pttm -142.81 177.87 8.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 74.239999999999995 110.852 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -142.79 120.8 12.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.245 -0.434 . . . . 62.140000000000001 111.098 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.85 32.68 0.8 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 70.230000000000004 111.1 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.07 -60.31 4.91 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.753 -0.737 . . . . 73.040000000000006 112.508 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -105.79 -13.04 15.66 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.864 0.364 . . . . 74.219999999999999 110.859 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.444 ' HG2' ' CG ' ' A' ' 59' ' ' GLN . 36.2 mtmt -121.24 148.36 44.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.158 -0.474 . . . . 74.329999999999998 110.877 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.414 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 3.5 t -125.76 111.12 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 72.400000000000006 111.152 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.484 ' CD2' ' HE2' ' A' ' 34' ' ' LYS . 3.6 m-85 -79.72 141.77 36.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 61.25 110.928 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.475 ' CD1' HG23 ' A' ' 58' ' ' THR . 63.6 m95 -130.29 166.28 20.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.033 -0.53 . . . . 75.409999999999997 110.938 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.0 ptt? -146.75 135.49 22.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 64.140000000000001 110.879 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.9 t -50.16 109.6 0.31 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 63.43 110.869 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.574 ' HE ' HD12 ' A' ' 29' ' ' LEU . 39.1 ptt85 -44.48 -23.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 74.430000000000007 110.923 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.485 ' HB3' HD12 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -85.47 30.86 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 61.329999999999998 110.856 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -82.01 -26.11 34.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 75.019999999999996 110.913 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.04 -23.56 16.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 71.310000000000002 111.17 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.0 tpp85 -96.7 -60.56 1.58 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.477 . . . . 64.209999999999994 110.86 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.535 HD13 ' CG ' ' A' ' 71' ' ' HIS . 34.8 mt -94.34 22.79 5.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 71.420000000000002 110.889 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 38.08 41.88 1.08 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.742 -0.742 . . . . 63.210000000000001 112.486 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.2 t -90.26 120.76 31.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.907 0.384 . . . . 70.099999999999994 110.814 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -99.3 13.33 33.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 63.329999999999998 110.862 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.7 t -65.03 117.74 8.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 64.239999999999995 110.874 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -114.87 159.4 20.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 75.219999999999999 110.917 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.697 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -144.74 164.45 30.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 71.319999999999993 111.097 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 64' ' ' MET . 69.1 mt -127.25 129.23 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.319999999999993 111.124 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.475 HG23 ' CD1' ' A' ' 42' ' ' TRP . 42.2 p -110.36 136.84 48.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 63.100000000000001 111.156 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.444 ' CG ' ' HG2' ' A' ' 39' ' ' LYS . 4.7 mt-30 -144.48 116.23 8.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 74.120000000000005 110.945 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 70.19 -99.2 0.69 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.71 -0.757 . . . . 64.200000000000003 112.535 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.26 4.84 5.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.763 0.316 . . . . 75.010000000000005 110.803 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 42.5 mtm180 -107.01 -175.22 2.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.209999999999994 110.817 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.801 HD13 ' CG ' ' A' ' 25' ' ' HIS . 21.3 tt -150.81 162.75 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 70.200000000000003 111.074 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.697 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 3.9 mpp? -141.6 147.66 37.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.108 -0.496 . . . . 62.219999999999999 110.864 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.7 t -116.76 130.13 72.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 71.040000000000006 111.121 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 19.4 mtp -89.42 -64.08 1.19 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.211 -0.449 . . . . 72.319999999999993 110.852 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.9 ttm180 -112.34 175.93 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.268 -0.424 . . . . 74.129999999999995 110.901 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.4 p -90.99 -176.18 4.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 75.319999999999993 110.909 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.433 ' CE1' ' HH ' ' A' ' 30' ' ' TYR . 88.3 m-70 -114.17 137.71 51.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 74.040000000000006 110.889 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.3 t -93.27 13.88 19.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.234 -0.439 . . . . 71.420000000000002 110.839 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.535 ' CG ' HD13 ' A' ' 50' ' ' LEU . 26.7 p80 -141.48 169.29 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 74.310000000000002 110.866 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.441 ' N ' ' CD ' ' A' ' 72' ' ' GLN . 1.8 mp0 -102.57 151.79 38.29 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.576 0.703 . . . . 55.539999999999999 110.92 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.88 149.6 66.32 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.639 2.226 . . . . 63.329999999999998 112.347 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -124.76 81.14 1.92 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 75.540000000000006 110.816 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.403 ' N ' HD23 ' A' ' 75' ' ' LEU . 6.5 mt -48.75 -22.9 0.88 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 62.350000000000001 110.919 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -75.24 -41.33 57.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.400000000000006 111.103 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -80.68 -31.38 36.59 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.724 -0.75 . . . . 71.420000000000002 112.486 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.6 tp -68.72 -38.31 80.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.707 0.289 . . . . 72.310000000000002 110.891 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -70.3 -34.72 73.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.187 -0.46 . . . . 75.329999999999998 110.896 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.93 -20.09 66.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 73.420000000000002 111.062 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.518 HD13 ' CD1' ' A' ' 29' ' ' LEU . 3.0 mt -90.15 -21.92 21.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 73.540000000000006 110.888 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.578 ' NH2' HG11 ' A' ' 24' ' ' VAL . 28.9 mtt180 . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 74.340000000000003 110.877 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.74 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 14.5 tp . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.735 0.302 . . . . 74.239999999999995 110.931 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.449 ' C ' ' CD1' ' A' ' 13' ' ' PHE . 34.0 tt0 -113.52 145.73 40.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 72.510000000000005 110.911 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.74 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 0.8 OUTLIER -140.0 167.9 21.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 75.400000000000006 110.898 -179.925 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.859 HD21 ' HG2' ' A' ' 82' ' ' ARG . 8.9 mt -137.57 117.53 13.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 63.420000000000002 111.012 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 72.209999999999994 110.903 179.953 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.811 0.339 . . . . 63.329999999999998 110.833 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -110.95 164.27 12.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 63.109999999999999 110.909 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.635 HD11 HD21 ' A' ' 11' ' ' LEU . 5.4 tp -129.16 113.68 15.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 74.540000000000006 110.962 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -88.01 112.08 23.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 74.030000000000001 111.11 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.808 ' CG ' HD13 ' A' ' 63' ' ' ILE . 9.2 t60 -149.27 125.49 10.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.151 -0.477 . . . . 72.439999999999998 110.821 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 63.21 42.96 6.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.24 -0.436 . . . . 75.109999999999999 110.904 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.7 m 56.05 19.94 4.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 45.149999999999999 110.902 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -116.83 -175.42 2.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.016 -0.538 . . . . 63.119999999999997 110.915 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.5 mt -136.61 133.6 36.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.161 -0.472 . . . . 71.340000000000003 110.922 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.515 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -129.23 163.06 26.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 73.430000000000007 110.914 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.8 mtp180 -124.77 139.88 53.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 71.200000000000003 110.928 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.8 tttt -60.91 116.18 4.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 72.120000000000005 110.898 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -91.97 -57.57 2.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 75.209999999999994 110.904 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.7 pttt -151.32 168.48 24.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 63.140000000000001 110.924 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -132.7 119.19 20.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 63.100000000000001 111.09 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -82.54 38.01 0.54 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 74.340000000000003 111.067 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.21 -50.59 4.0 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.755 -0.736 . . . . 60.100000000000001 112.5 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -114.44 -27.81 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.908 0.385 . . . . 54.520000000000003 110.878 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.767 ' HE2' HD13 ' A' ' 57' ' ' ILE . 52.0 mtpt -104.61 154.81 19.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 73.200000000000003 110.883 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 t -127.87 111.97 26.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.275 -0.421 . . . . 74.230000000000004 111.102 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.521 ' CZ ' HD11 ' A' ' 57' ' ' ILE . 3.4 m-85 -79.45 145.27 33.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 62.130000000000003 110.893 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.619 ' CD1' HG23 ' A' ' 58' ' ' THR . 66.5 m95 -135.3 163.14 30.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.117 -0.492 . . . . 73.140000000000001 110.875 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.9 ptt? -145.79 132.06 19.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 71.019999999999996 110.909 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.406 ' C ' ' N ' ' A' ' 46' ' ' ASP . 1.8 t -46.1 108.46 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 72.439999999999998 110.813 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -43.49 -23.65 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 70.349999999999994 110.858 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.446 ' CB ' HD12 ' A' ' 50' ' ' LEU . 3.3 m-20 -81.39 42.06 0.65 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 64.510000000000005 110.822 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -85.8 -36.09 20.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 71.230000000000004 110.934 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.89 -14.57 20.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 63.310000000000002 111.128 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -98.91 -53.71 3.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 60.149999999999999 110.914 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.447 ' O ' ' C ' ' A' ' 51' ' ' GLY . 33.9 mt -108.01 27.34 9.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.201 -0.454 . . . . 72.439999999999998 110.903 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.447 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.63 47.08 0.61 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.761 -0.733 . . . . 70.409999999999997 112.484 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.3 t -97.59 142.71 29.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.759 0.314 . . . . 40.039999999999999 110.895 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.43 ' HD2' ' N ' ' A' ' 53' ' ' ARG . 0.4 OUTLIER -118.37 -0.87 11.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.172 -0.467 . . . . 74.140000000000001 110.926 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.556 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . 1.1 t -52.43 116.13 2.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.205 -0.452 . . . . 64.030000000000001 110.862 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.6 mtm105 -111.14 171.16 7.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 72.040000000000006 110.819 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.635 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -160.68 151.32 18.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 74.420000000000002 111.092 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.767 HD13 ' HE2' ' A' ' 39' ' ' LYS . 23.0 mt -115.49 130.16 70.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 74.219999999999999 111.099 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.619 HG23 ' CD1' ' A' ' 42' ' ' TRP . 28.3 p -111.32 141.47 44.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 50.210000000000001 111.156 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.415 ' NE2' ' HG2' ' A' ' 39' ' ' LYS . 10.7 mt-30 -146.72 109.3 4.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 75.25 110.9 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 75.29 -95.95 0.98 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.718 -0.753 . . . . 72.420000000000002 112.448 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -129.03 1.18 5.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.804 0.335 . . . . 73.420000000000002 110.818 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.7 mmm-85 -102.79 -176.41 3.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 74.129999999999995 110.894 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.808 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.4 161.97 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.199 -0.455 . . . . 63.439999999999998 111.158 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.635 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 16.8 ttm -138.62 141.28 39.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 61.219999999999999 110.933 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.2 t -106.41 133.25 51.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 53.030000000000001 111.129 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 23.5 mmt -93.87 -65.1 1.01 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 74.120000000000005 110.956 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -119.5 -178.27 3.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 63.530000000000001 110.903 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 77.3 p -91.82 -175.36 4.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 73.019999999999996 110.895 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.556 ' CE1' ' HB3' ' A' ' 54' ' ' SER . 75.8 m-70 -117.84 144.09 45.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 63.049999999999997 110.896 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 90.0 m -97.07 11.2 37.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 72.030000000000001 110.873 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 28.6 p80 -139.08 166.28 24.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 72.310000000000002 110.873 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -97.7 152.29 38.06 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.569 0.699 . . . . 74.049999999999997 110.953 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.71 160.31 50.2 Favored 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 122.755 2.303 . . . . 64.230000000000004 112.264 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.24 93.48 2.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.115 -0.493 . . . . 75.519999999999996 110.841 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.754 HD23 ' N ' ' A' ' 75' ' ' LEU . 0.5 OUTLIER -60.99 -22.18 64.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 74.239999999999995 110.93 -179.93 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.2 -55.38 9.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 63.130000000000003 111.124 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.22 -29.1 74.29 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.687 -0.768 . . . . 73.230000000000004 112.536 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 10.9 tp -77.33 -48.59 16.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.788 0.327 . . . . 60.020000000000003 110.896 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -64.19 -25.0 67.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 63.549999999999997 110.849 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.44 -25.73 63.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 74.409999999999997 111.121 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mt -79.12 -49.63 12.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.166 -0.47 . . . . 62.210000000000001 110.915 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.859 ' HG2' HD21 ' A' ' 14' ' ' LEU . 19.8 mtm180 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.481 . . . . 54.539999999999999 110.907 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.743 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 15.8 tp . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.781 0.324 . . . . 71.540000000000006 110.875 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -106.42 151.04 25.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 43.130000000000003 110.85 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.743 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 48.9 m-85 -139.98 170.52 15.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 74.420000000000002 110.866 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.5 mt -143.89 162.25 36.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 71.239999999999995 110.936 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.7 mtt85 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 74.310000000000002 110.896 179.93 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.803 0.335 . . . . 73.519999999999996 110.899 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -116.04 165.29 13.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 75.239999999999995 110.904 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.591 HD22 ' CG ' ' A' ' 42' ' ' TRP . 10.6 tp -131.71 117.59 18.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 73.239999999999995 110.86 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.685 HG11 ' NH2' ' A' ' 82' ' ' ARG . 97.5 t -93.55 111.7 25.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.453 . . . . 73.329999999999998 111.101 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.817 ' CG ' HD13 ' A' ' 63' ' ' ILE . 57.5 t60 -147.98 132.61 17.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 73.239999999999995 110.832 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.422 ' HG3' ' NE2' ' A' ' 25' ' ' HIS . 23.6 mt-10 59.6 35.58 22.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 73.209999999999994 110.892 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m 63.43 29.32 15.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 75.040000000000006 110.909 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 22.1 m-85 -130.72 -178.17 4.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 70.340000000000003 110.91 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.408 HD13 ' HE ' ' A' ' 45' ' ' ARG . 16.2 mt -133.38 133.15 42.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 72.5 110.913 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.495 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.2 m-85 -125.71 161.51 27.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 60.229999999999997 110.919 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.473 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 3.3 mtt-85 -115.63 126.35 54.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 72.400000000000006 110.822 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.505 ' HB2' ' CH2' ' A' ' 42' ' ' TRP . 15.6 ttpt -57.45 110.07 0.8 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.451 . . . . 73.409999999999997 110.86 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -82.38 -58.14 3.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 74.430000000000007 110.891 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.1 pttp -149.88 -176.66 5.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 45.329999999999998 110.88 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.58 117.17 7.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 65.519999999999996 111.173 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.34 80.23 4.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 51.119999999999997 111.098 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.68 -78.14 0.37 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.717 -0.754 . . . . 64.409999999999997 112.503 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -116.19 -13.8 11.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.963 0.411 . . . . 74.430000000000007 110.938 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.634 ' HE3' HG21 ' A' ' 57' ' ' ILE . 26.8 mtpp -94.08 149.64 21.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.114 -0.494 . . . . 75.430000000000007 110.937 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.408 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 1.7 t -132.55 118.99 37.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 72.349999999999994 111.126 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -87.49 134.22 33.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 74.450000000000003 110.898 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.591 ' CG ' HD22 ' A' ' 23' ' ' LEU . 68.5 m95 -124.32 168.17 13.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 73.400000000000006 110.893 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -152.86 133.54 13.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.246 -0.434 . . . . 75.540000000000006 110.866 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -42.89 111.02 0.22 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.43 . . . . 73.310000000000002 110.888 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 31' ' ' ARG . 37.0 ptt85 -52.36 -19.32 2.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 72.319999999999993 110.844 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.16 10.81 3.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.181 -0.463 . . . . 73.049999999999997 110.895 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -68.75 -8.41 42.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 64.109999999999999 110.88 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.81 -43.95 7.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 71.549999999999997 111.067 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -93.38 -47.83 6.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 45.100000000000001 110.848 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.418 HD13 ' CG ' ' A' ' 71' ' ' HIS . 29.5 mt -88.93 -12.48 41.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 55.130000000000003 110.922 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 70.59 -0.51 26.51 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.789 -0.72 . . . . 71.430000000000007 112.484 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.403 ' O ' ' CB ' ' A' ' 47' ' ' GLN . 32.9 t -47.2 144.76 2.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.824 0.345 . . . . 60.340000000000003 110.884 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -125.07 19.29 8.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 72.319999999999993 110.895 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.418 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . 32.3 t -66.86 111.64 3.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 72.209999999999994 110.862 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -109.98 145.19 37.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 74.310000000000002 110.934 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.583 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -137.37 154.93 49.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.22 -0.445 . . . . 62.020000000000003 111.029 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.634 HG21 ' HE3' ' A' ' 39' ' ' LYS . 75.7 mt -111.33 135.12 51.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 74.5 111.103 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.6 p -117.84 128.76 55.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 61.549999999999997 111.18 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.405 ' CG ' ' HG2' ' A' ' 39' ' ' LYS . 9.8 mt-30 -131.81 95.1 3.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 71.200000000000003 110.85 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 87.4 -95.44 2.08 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.74 -0.743 . . . . 65.340000000000003 112.502 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -127.09 0.23 6.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.797 0.332 . . . . 72.310000000000002 110.882 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.3 mmm-85 -104.18 -179.26 3.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 63.240000000000002 110.814 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.817 HD13 ' CG ' ' A' ' 25' ' ' HIS . 17.6 tt -150.3 160.57 4.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 72.400000000000006 111.147 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.583 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 4.5 mpp? -137.65 140.99 41.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 71.450000000000003 110.896 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 92.6 t -102.7 127.9 56.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 71.430000000000007 111.113 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.7 mtm -105.16 -16.59 14.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 110.865 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -154.49 160.28 41.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 75.409999999999997 110.851 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 88.2 p -90.09 179.25 5.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 62.439999999999998 110.831 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.486 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 38.4 m-70 -116.5 134.28 55.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.089 -0.505 . . . . 64.540000000000006 110.881 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 45.4 t -85.85 4.94 34.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 44.310000000000002 110.854 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.418 ' CG ' HD13 ' A' ' 50' ' ' LEU . 28.2 p80 -131.6 163.97 26.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.454 . . . . 74.319999999999993 110.869 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -100.82 149.21 35.99 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.617 0.722 . . . . 73.109999999999999 110.898 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.49 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 54.3 Cg_endo -69.71 156.47 63.39 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.692 2.261 . . . . 62.149999999999999 112.395 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.93 95.69 3.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.233 -0.439 . . . . 71.400000000000006 110.885 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mt -57.06 -14.82 4.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 64.319999999999993 110.924 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -74.47 -46.26 40.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.249 -0.432 . . . . 63.100000000000001 111.148 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.67 -31.57 40.11 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.686 -0.768 . . . . 62.420000000000002 112.508 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -70.66 -42.49 70.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.786 0.327 . . . . 64.510000000000005 110.964 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -64.56 -35.76 82.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 71.519999999999996 110.934 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.37 -37.98 79.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 70.400000000000006 111.083 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.3 mt -69.94 -22.58 63.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.272 -0.422 . . . . 75.329999999999998 110.916 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.685 ' NH2' HG11 ' A' ' 24' ' ' VAL . 35.7 mtt180 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 72.150000000000006 110.891 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.976 HD21 HD11 ' A' ' 23' ' ' LEU . 11.1 tp . . . . . 0 N--CA 1.458 -0.067 0 CA-C-O 120.788 0.328 . . . . 74.439999999999998 110.892 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.406 ' CD ' ' NH1' ' A' ' 82' ' ' ARG . 24.8 tt0 -104.51 144.45 31.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 74.319999999999993 110.916 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.405 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 20.4 m-85 -140.03 171.92 13.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 65.219999999999999 110.85 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.675 HD11 ' CD ' ' A' ' 82' ' ' ARG . 6.2 mt -144.21 155.82 44.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 73.140000000000001 110.973 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 72.400000000000006 110.822 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.91 0.386 . . . . 74.519999999999996 110.822 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -129.26 158.6 38.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 65.349999999999994 110.868 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.976 HD11 HD21 ' A' ' 11' ' ' LEU . 11.1 tp -123.18 116.12 22.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 73.340000000000003 110.897 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.53 116.19 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 75.120000000000005 111.152 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.809 ' CG ' HD13 ' A' ' 63' ' ' ILE . 10.5 t60 -152.29 126.73 9.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 63.310000000000002 110.874 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 62.29 42.79 8.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.26 -0.427 . . . . 63.340000000000003 110.914 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.7 m 55.22 27.73 10.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.487 . . . . 73.430000000000007 110.847 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -125.99 -176.49 3.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 73.439999999999998 110.893 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 19.4 mt -135.33 131.99 37.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 72.040000000000006 110.895 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.515 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -126.7 168.77 13.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.473 . . . . 75.219999999999999 110.968 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -127.97 138.92 52.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 54.530000000000001 110.888 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.501 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 33.6 tttp -63.2 112.38 2.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 74.140000000000001 110.936 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -86.73 -58.39 2.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 72.439999999999998 110.921 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.5 pttm -146.88 -177.58 5.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.145 -0.48 . . . . 74.230000000000004 110.864 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -144.41 121.83 11.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 75.430000000000007 111.184 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.5 51.11 2.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 62.210000000000001 111.121 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.94 -59.8 3.05 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.799 -0.715 . . . . 64.219999999999999 112.501 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.413 ' CD ' ' N ' ' A' ' 38' ' ' GLU . 13.5 mp0 -112.91 -30.19 7.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.896 0.379 . . . . 75.140000000000001 110.861 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.515 ' NZ ' HG21 ' A' ' 57' ' ' ILE . 18.4 mtpp -94.1 153.77 17.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 74.219999999999999 110.872 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.2 t -129.24 115.34 35.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.267 -0.424 . . . . 74.340000000000003 111.144 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -80.76 144.21 32.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 73.099999999999994 110.898 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.501 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 72.0 m95 -135.04 163.22 30.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 74.409999999999997 110.902 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.9 ptt? -148.19 131.59 16.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 62.149999999999999 110.932 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.0 t -42.31 115.31 0.67 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.289 -0.414 . . . . 65.109999999999999 110.812 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 39.4 ptt85 -50.5 -18.96 0.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 73.400000000000006 110.886 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.692 ' CB ' HD12 ' A' ' 50' ' ' LEU . 6.2 m-20 -88.26 32.06 0.78 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.461 . . . . 74.430000000000007 110.87 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.582 ' NE2' ' HB2' ' A' ' 48' ' ' ALA . 1.2 pm0 -84.6 -14.53 48.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 73.0 110.865 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.582 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . . . -97.04 -46.3 6.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 61.539999999999999 111.133 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.1 ttt180 -84.48 -55.23 4.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.196 -0.456 . . . . 75.340000000000003 110.82 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.692 HD12 ' CB ' ' A' ' 46' ' ' ASP . 64.6 mt -88.07 9.56 22.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.289 -0.414 . . . . 74.530000000000001 110.957 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.8 35.48 2.18 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.746 -0.74 . . . . 62.520000000000003 112.47 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.423 ' N ' ' HA ' ' A' ' 47' ' ' GLN . 32.2 t -78.5 125.52 29.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.787 0.327 . . . . 70.310000000000002 110.878 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.65 19.31 18.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 63.140000000000001 110.863 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.7 t -69.64 125.67 27.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 64.340000000000003 110.855 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -122.48 159.52 27.48 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.164 -0.471 . . . . 54.140000000000001 110.91 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.561 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -151.74 149.48 29.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 35.140000000000001 111.075 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.515 HG21 ' NZ ' ' A' ' 39' ' ' LYS . 61.4 mt -117.7 131.08 71.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 74.109999999999999 111.139 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.639 HG22 HG13 ' A' ' 63' ' ' ILE . 30.1 p -115.66 144.69 43.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 64.239999999999995 111.217 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -130.39 94.66 3.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 72.120000000000005 110.96 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 78.55 -85.65 1.15 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.78 -0.724 . . . . 60.299999999999997 112.489 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -128.07 5.29 5.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.768 0.318 . . . . 55.200000000000003 110.854 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -102.8 176.98 4.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.206 -0.452 . . . . 73.219999999999999 110.835 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.809 HD13 ' CG ' ' A' ' 25' ' ' HIS . 18.3 tt -150.79 149.82 13.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.126 -0.488 . . . . 74.200000000000003 111.115 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.561 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 53.7 mtm -138.27 140.12 39.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 75.120000000000005 110.862 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.401 ' CG2' ' NE2' ' A' ' 25' ' ' HIS . 66.8 t -99.43 142.21 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 71.209999999999994 111.101 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 29.0 mmm -103.4 -62.25 1.31 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 65.230000000000004 110.926 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 -114.99 -175.75 2.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.305 -0.407 . . . . 64.510000000000005 110.882 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.7 p -96.91 -175.57 3.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 74.239999999999995 110.892 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.453 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 69.5 m-70 -117.74 135.31 54.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 53.420000000000002 110.866 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.3 t -90.1 14.94 11.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 63.130000000000003 110.927 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.578 ' CG ' HD13 ' A' ' 50' ' ' LEU . 25.2 p80 -143.36 162.29 36.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 75.329999999999998 110.829 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -93.59 152.84 41.17 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.645 0.736 . . . . 71.329999999999998 110.874 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 154.92 67.18 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.702 2.268 . . . . 72.299999999999997 112.375 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.26 82.34 2.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 75.140000000000001 110.897 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.1 mt -53.79 -16.32 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 73.040000000000006 110.906 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.05 -52.6 13.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 53.020000000000003 111.102 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.9 -30.11 64.03 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.666 -0.778 . . . . 65.299999999999997 112.442 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.6 tp -73.03 -46.06 54.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.86 0.362 . . . . 64.400000000000006 110.922 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.57 -36.51 78.67 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.216 -0.447 . . . . 65.420000000000002 110.837 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.47 -32.11 66.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 62.229999999999997 111.115 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.6 mt -73.57 -42.69 61.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 74.420000000000002 110.903 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.675 ' CD ' HD11 ' A' ' 14' ' ' LEU . 1.6 mpp_? . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 70.409999999999997 110.865 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.659 HD21 HD11 ' A' ' 23' ' ' LEU . 11.7 tp . . . . . 0 CA--C 1.526 0.051 0 CA-C-O 120.846 0.355 . . . . 72.230000000000004 110.853 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -104.47 136.24 44.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.131 -0.486 . . . . 63.219999999999999 110.902 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.438 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 94.4 m-85 -126.85 163.4 23.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 73.239999999999995 110.904 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.8 HD12 ' CG2' ' A' ' 24' ' ' VAL . 1.4 mt -148.9 153.31 37.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.136 -0.483 . . . . 71.120000000000005 110.893 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 ppt_? . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 73.150000000000006 110.84 179.954 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.1 tpp180 . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.738 0.304 . . . . 73.25 110.916 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -99.0 168.93 9.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 73.530000000000001 110.914 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.659 HD11 HD21 ' A' ' 11' ' ' LEU . 7.9 tp -123.85 114.13 19.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.112 -0.494 . . . . 72.430000000000007 110.894 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.8 ' CG2' HD12 ' A' ' 14' ' ' LEU . 43.0 t -90.74 110.75 22.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.45 . . . . 73.230000000000004 111.106 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.95 ' CG ' HD13 ' A' ' 63' ' ' ILE . 32.6 t60 -147.65 125.07 11.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 72.239999999999995 110.868 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 63.24 38.41 10.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.243 -0.435 . . . . 70.540000000000006 110.863 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.578 ' OG ' HD23 ' A' ' 75' ' ' LEU . 22.2 t 62.6 15.41 7.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 62.329999999999998 110.898 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -112.59 177.58 4.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.115 -0.493 . . . . 75.140000000000001 110.884 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.444 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 44.6 mt -132.46 129.7 39.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 55.039999999999999 110.927 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.499 ' HB2' HD23 ' A' ' 23' ' ' LEU . 1.2 m-85 -124.53 175.4 7.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 73.209999999999994 110.897 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 30.0 mtp180 -133.47 139.22 46.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 74.150000000000006 110.852 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -64.75 111.14 2.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 73.310000000000002 110.93 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -86.96 -57.91 2.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 75.510000000000005 110.909 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.75 167.89 27.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 54.130000000000003 110.881 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -127.38 131.61 50.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.224 -0.444 . . . . 61.32 111.093 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -117.71 100.05 7.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 62.049999999999997 111.129 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.33 -96.44 0.2 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.705 -0.76 . . . . 65.409999999999997 112.431 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -113.55 2.34 15.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.91 0.386 . . . . 72.430000000000007 110.896 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -105.07 157.6 17.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 75.5 110.847 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.5 t -136.66 116.67 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 44.200000000000003 111.137 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -79.09 146.71 33.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 73.510000000000005 110.956 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.509 ' CG ' HD22 ' A' ' 23' ' ' LEU . 69.1 m95 -136.51 167.38 21.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 71.310000000000002 110.981 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.6 ptt? -152.52 132.64 13.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.427 . . . . 71.040000000000006 110.86 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -45.43 113.93 0.67 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.215 -0.448 . . . . 73.439999999999998 110.893 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.448 ' NH2' HD11 ' A' ' 81' ' ' LEU . 18.0 ptt180 -54.89 -28.74 52.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 73.400000000000006 110.87 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.47 48.19 1.54 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 41.530000000000001 110.866 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -84.76 -37.04 21.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 74.129999999999995 110.95 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.17 -12.9 29.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 72.219999999999999 111.078 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.94 -40.99 7.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 72.530000000000001 110.855 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.641 HD13 ' CG ' ' A' ' 71' ' ' HIS . 90.3 mt -114.76 23.99 12.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 71.230000000000004 110.886 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.96 53.14 0.86 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.707 -0.759 . . . . 73.510000000000005 112.5 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.61 118.45 25.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.86 0.362 . . . . 75.439999999999998 110.897 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.8 mmt85 -105.58 50.23 0.78 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 73.329999999999998 110.815 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.3 t -87.33 117.26 25.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 74.120000000000005 110.806 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -105.15 161.55 14.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.141 -0.481 . . . . 73.439999999999998 110.902 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.782 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -148.08 163.01 38.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 64.150000000000006 111.059 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 70.2 mt -127.32 127.79 69.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 74.329999999999998 111.117 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.644 HG22 HG13 ' A' ' 63' ' ' ILE . 42.1 p -110.94 144.31 40.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 73.319999999999993 111.191 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -128.46 90.29 3.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.415 . . . . 74.030000000000001 110.995 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.95 -86.73 0.97 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.732 -0.747 . . . . 61.310000000000002 112.456 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -124.68 7.87 8.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.771 0.32 . . . . 73.120000000000005 110.854 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.443 ' HG3' ' N ' ' A' ' 63' ' ' ILE . 10.3 ptt180 -105.82 180.0 4.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 72.340000000000003 110.831 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.95 HD13 ' CG ' ' A' ' 25' ' ' HIS . 17.5 tt -151.0 153.8 9.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 65.400000000000006 111.166 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.782 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 30.3 ttp -144.3 147.1 33.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 63.32 110.924 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 t -116.88 145.69 22.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 71.310000000000002 111.125 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 2.4 mtt -112.38 -62.31 1.59 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 72.299999999999997 110.871 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 -96.32 177.48 5.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.277 -0.42 . . . . 63.439999999999998 110.836 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.7 m -100.64 174.02 6.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 65.420000000000002 110.819 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.411 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 74.4 m-70 -107.88 127.69 53.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 73.209999999999994 110.85 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 8.2 t -82.53 14.74 2.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 73.420000000000002 110.897 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.641 ' CG ' HD13 ' A' ' 50' ' ' LEU . 27.8 p80 -145.12 153.12 41.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 75.040000000000006 110.842 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -86.8 152.49 54.01 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.621 0.724 . . . . 64.420000000000002 110.89 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 152.85 69.54 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.676 2.251 . . . . 60.130000000000003 112.377 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.55 90.95 3.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 52.039999999999999 110.878 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.578 HD23 ' OG ' ' A' ' 27' ' ' SER . 18.8 mt -58.69 -31.13 67.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 54.200000000000003 110.92 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -68.58 -31.97 71.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 63.210000000000001 111.153 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -88.54 -37.5 7.48 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.675 -0.774 . . . . 43.340000000000003 112.534 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.585 HD11 HG13 ' A' ' 24' ' ' VAL . 10.2 tp -72.6 -40.09 66.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.722 0.296 . . . . 72.129999999999995 110.892 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.567 ' N ' HH21 ' A' ' 82' ' ' ARG . 30.8 mm-40 -64.22 -30.35 71.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 63.219999999999999 110.867 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.12 -59.53 4.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 44.0 111.095 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.448 HD11 ' NH2' ' A' ' 45' ' ' ARG . 14.4 mt -39.47 -43.46 1.25 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.97 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.567 HH21 ' N ' ' A' ' 79' ' ' GLU . 55.6 mtm180 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.101 -0.5 . . . . 74.239999999999995 110.878 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.869 HD21 HD11 ' A' ' 23' ' ' LEU . 25.9 tp . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.816 0.341 . . . . 63.549999999999997 110.933 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.511 ' OE2' HG21 ' A' ' 24' ' ' VAL . 21.6 tt0 -102.32 150.0 23.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 73.340000000000003 110.908 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.436 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 37.1 m-85 -139.42 172.05 13.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.114 -0.494 . . . . 74.420000000000002 110.914 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.424 HD12 HD21 ' A' ' 29' ' ' LEU . 10.9 mt -144.45 151.78 39.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 73.040000000000006 110.94 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.4 ' HG2' ' CD ' ' A' ' 21' ' ' ARG . 79.1 mtm-85 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.269 -0.423 . . . . 74.129999999999995 110.866 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.4 ' CD ' ' HG2' ' A' ' 15' ' ' ARG . 11.6 tpt180 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.924 0.392 . . . . 74.239999999999995 110.842 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.434 ' HB3' HD22 ' A' ' 29' ' ' LEU . 2.7 m-85 -107.45 158.79 16.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 65.409999999999997 110.875 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.869 HD11 HD21 ' A' ' 11' ' ' LEU . 8.9 tp -125.1 114.64 19.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.16 -0.473 . . . . 73.349999999999994 110.91 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.511 HG21 ' OE2' ' A' ' 12' ' ' GLU . 53.5 t -87.96 119.46 35.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 74.150000000000006 111.124 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.915 ' CG ' HD13 ' A' ' 63' ' ' ILE . 25.2 t60 -156.45 126.17 6.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.247 -0.433 . . . . 71.439999999999998 110.937 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 61.53 41.07 12.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.234 -0.439 . . . . 75.030000000000001 110.87 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.413 ' HB2' ' CB ' ' A' ' 73' ' ' PRO . 10.3 m 58.37 32.44 22.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.091 -0.504 . . . . 74.310000000000002 110.858 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -131.41 -175.48 3.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 65.010000000000005 110.938 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.449 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 29.3 mt -140.63 133.23 28.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 74.299999999999997 110.886 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.51 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.1 m-85 -127.89 162.64 26.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 70.25 110.915 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.5 mtp180 -120.74 136.16 54.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 75.230000000000004 110.897 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.552 ' NZ ' ' HB2' ' A' ' 35' ' ' ALA . 38.5 tttp -58.66 112.07 1.49 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 62.43 110.97 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.44 ' OE1' ' NH2' ' A' ' 55' ' ' ARG . 1.6 tm-20 -82.87 -51.22 7.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.431 . . . . 73.099999999999994 110.937 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.57 ' HD3' ' CD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -158.52 179.12 9.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 74.340000000000003 110.898 179.935 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.552 ' HB2' ' NZ ' ' A' ' 32' ' ' LYS . . . -130.78 135.31 47.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 63.0 111.098 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -118.76 -172.58 2.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 51.009999999999998 111.111 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.25 92.12 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 74.239999999999995 112.478 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 66.71 43.24 2.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.917 0.389 . . . . 44.219999999999999 110.914 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -154.26 159.18 41.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 71.340000000000003 110.882 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.3 t -135.78 121.01 28.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 64.450000000000003 111.096 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.57 ' CD1' ' HD3' ' A' ' 34' ' ' LYS . 8.9 m-85 -85.39 149.12 25.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 75.230000000000004 110.914 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.437 ' CD1' HG23 ' A' ' 58' ' ' THR . 70.0 m95 -143.0 149.76 38.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 73.5 110.914 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -135.36 130.83 35.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 71.150000000000006 110.913 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.432 ' O ' ' N ' ' A' ' 46' ' ' ASP . 2.2 t -46.59 107.56 0.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 73.129999999999995 110.861 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.449 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.7 ptt-85 -40.23 -27.28 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 72.200000000000003 110.843 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 44' ' ' CYS . 0.3 OUTLIER -88.8 40.52 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 71.239999999999995 110.845 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -86.43 -37.46 18.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 73.519999999999996 110.909 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.62 -15.08 23.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 74.329999999999998 111.079 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.8 tpp180 -92.41 -61.93 1.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 63.340000000000003 110.89 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.1 mt -103.54 29.17 5.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 52.549999999999997 110.954 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.59 47.31 4.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.757 -0.735 . . . . 42.329999999999998 112.501 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.2 t -105.5 72.86 0.99 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.893 0.378 . . . . 65.329999999999998 110.931 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.474 ' HD3' ' N ' ' A' ' 54' ' ' SER . 0.0 OUTLIER -55.88 -13.88 2.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.12 -0.491 . . . . 75.400000000000006 110.828 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.474 ' N ' ' HD3' ' A' ' 53' ' ' ARG . 3.4 t -35.55 122.72 0.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 54.450000000000003 110.89 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.44 ' NH2' ' OE1' ' A' ' 33' ' ' GLU . 37.5 mtp180 -118.71 177.06 4.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 71.5 110.876 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.413 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -161.62 151.4 16.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 53.520000000000003 111.091 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.794 HD12 ' CE ' ' A' ' 66' ' ' MET . 61.7 mt -121.84 133.63 67.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 73.099999999999994 111.098 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.562 HG22 HG13 ' A' ' 63' ' ' ILE . 22.7 p -116.01 144.39 44.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 71.430000000000007 111.146 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -126.79 88.94 2.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 74.230000000000004 110.928 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 81.55 -86.92 1.39 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.711 -0.757 . . . . 72.329999999999998 112.417 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -126.03 8.12 7.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.752 0.31 . . . . 71.439999999999998 110.845 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.411 ' HG3' ' N ' ' A' ' 63' ' ' ILE . 8.2 ptm180 -106.42 179.82 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 71.109999999999999 110.867 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.915 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.95 151.73 12.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 65.239999999999995 111.162 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.433 ' N ' ' O ' ' A' ' 57' ' ' ILE . 3.9 mpp? -140.91 140.11 34.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 64.510000000000005 110.904 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.5 t -109.8 140.25 29.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 61.299999999999997 111.085 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.794 ' CE ' HD12 ' A' ' 57' ' ' ILE . 6.8 mmt -104.0 -53.78 2.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.153 -0.476 . . . . 73.209999999999994 110.864 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.3 mtp85 -115.05 167.67 10.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 74.409999999999997 110.93 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.0 m -86.54 -175.76 5.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 74.099999999999994 110.848 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 63.6 m-70 -118.85 137.3 53.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.17 -0.468 . . . . 64.5 110.841 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 16.6 t -91.29 9.99 29.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 51.200000000000003 110.786 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 33.0 p80 -138.23 157.3 46.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 75.329999999999998 110.916 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -89.96 156.49 46.81 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.599 0.714 . . . . 52.240000000000002 110.898 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.413 ' CB ' ' HB2' ' A' ' 27' ' ' SER . 54.0 Cg_endo -69.7 140.19 42.31 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.727 2.285 . . . . 61.340000000000003 112.335 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -102.53 80.95 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 71.030000000000001 110.903 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 57.2 mt -53.78 -16.47 1.74 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 62.340000000000003 110.963 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.22 -57.65 2.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.441 . . . . 53.039999999999999 111.073 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.79 -33.67 83.89 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.726 -0.749 . . . . 74.129999999999995 112.453 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.9 tp -70.53 -49.52 47.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.784 0.326 . . . . 75.420000000000002 110.936 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -62.24 -31.75 72.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 63.109999999999999 110.844 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.61 -54.57 22.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 73.099999999999994 111.063 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 15.8 mt -56.19 -32.39 64.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 60.439999999999998 110.928 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 6.5 mtp-105 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 75.219999999999999 110.917 179.91 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.908 HD21 HD11 ' A' ' 23' ' ' LEU . 22.6 tp . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.733 0.301 . . . . 60.219999999999999 110.925 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.468 ' C ' ' CD1' ' A' ' 13' ' ' PHE . 4.8 tp10 -118.57 150.03 40.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 72.140000000000001 110.881 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.756 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 1.9 m-85 -139.97 168.05 20.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 74.030000000000001 110.865 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.687 HD21 ' HG2' ' A' ' 82' ' ' ARG . 8.6 mt -135.26 117.24 15.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.17 -0.468 . . . . 72.409999999999997 110.896 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.3 ttt-85 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 55.450000000000003 110.842 179.974 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 tpp85 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.856 0.36 . . . . 74.340000000000003 110.848 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -116.01 160.59 20.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 63.240000000000002 110.833 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.908 HD11 HD21 ' A' ' 11' ' ' LEU . 8.1 tp -122.63 113.89 19.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.065 -0.516 . . . . 73.219999999999999 110.908 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 88.8 t -88.6 117.57 32.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 73.530000000000001 111.115 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.77 ' CG ' HD13 ' A' ' 63' ' ' ILE . 8.4 t60 -153.22 124.88 7.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 70.299999999999997 110.889 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 62.17 45.3 7.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.278 -0.419 . . . . 32.219999999999999 110.909 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 53.61 21.95 2.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.139 -0.482 . . . . 70.239999999999995 110.831 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -119.57 -179.95 4.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 63.43 110.902 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' C ' ' CD1' ' A' ' 30' ' ' TYR . 43.6 mt -129.91 136.99 50.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 74.319999999999993 110.924 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.519 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -133.6 167.06 21.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 73.420000000000002 110.936 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.8 mtp180 -130.34 138.27 50.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 72.420000000000002 110.874 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 31.4 tttm -57.12 119.92 7.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.219 -0.446 . . . . 74.129999999999995 110.897 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -95.83 -55.09 3.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.282 -0.417 . . . . 74.140000000000001 110.876 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 45.5 pttt -151.13 178.68 8.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.107 -0.497 . . . . 75.329999999999998 110.864 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.02 121.21 15.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 54.109999999999999 111.19 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.4 56.74 3.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 63.140000000000001 111.094 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.31 -65.75 3.77 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.739 -0.743 . . . . 60.32 112.492 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -117.37 -20.87 8.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.883 0.373 . . . . 72.040000000000006 110.87 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.4 mtmm -93.4 161.32 14.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 75.040000000000006 110.937 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 t -137.03 116.12 15.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.29 -0.414 . . . . 74.209999999999994 111.12 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.435 ' CE2' HD11 ' A' ' 57' ' ' ILE . 6.3 m-85 -81.67 149.78 28.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 65.019999999999996 110.929 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.61 ' CG ' HD22 ' A' ' 23' ' ' LEU . 62.9 m95 -138.75 158.59 43.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.102 -0.499 . . . . 64.420000000000002 110.857 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 7.0 ptt? -142.24 137.97 31.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 73.310000000000002 110.867 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.41 ' C ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -46.42 108.39 0.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 74.400000000000006 110.906 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -44.4 -22.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 71.129999999999995 110.848 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.41 ' N ' ' C ' ' A' ' 44' ' ' CYS . 0.5 OUTLIER -84.09 35.79 0.54 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.438 . . . . 70.420000000000002 110.904 179.945 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -48.27 -65.28 0.59 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.182 -0.463 . . . . 54.350000000000001 110.941 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -92.56 -33.07 14.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.226 -0.443 . . . . 73.129999999999995 111.096 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.75 -46.2 70.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.235 -0.439 . . . . 61.210000000000001 110.928 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 58.7 mt -123.69 25.93 7.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 63.5 110.872 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 39.36 43.94 2.16 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.694 -0.765 . . . . 64.349999999999994 112.529 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.4 t -96.89 148.24 23.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.35 . . . . 74.319999999999993 110.854 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.79 33.91 3.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.182 -0.463 . . . . 73.239999999999995 110.902 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.41 ' HG ' ' CD2' ' A' ' 69' ' ' HIS . 32.5 t -84.9 118.18 24.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 73.430000000000007 110.854 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -112.29 146.55 38.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 64.420000000000002 110.837 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.652 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -137.41 157.33 46.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 64.200000000000003 111.139 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.435 HD11 ' CE2' ' A' ' 41' ' ' TYR . 84.7 mt -123.18 126.16 73.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 51.520000000000003 111.074 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.507 HG23 ' CD1' ' A' ' 42' ' ' TRP . 43.0 p -102.02 152.15 21.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 62.520000000000003 111.131 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.8 tm0? -154.61 108.03 2.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 73.450000000000003 110.87 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.02 -97.35 0.92 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.774 -0.727 . . . . 72.140000000000001 112.571 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -128.77 11.25 6.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.812 0.339 . . . . 74.549999999999997 110.81 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -117.63 176.4 5.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 75.329999999999998 110.863 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.77 HD13 ' CG ' ' A' ' 25' ' ' HIS . 21.2 tt -143.92 159.43 16.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 62.43 111.147 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.652 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 5.6 ttp -135.72 148.97 49.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 75.120000000000005 110.914 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.6 t -120.13 142.61 35.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 43.530000000000001 111.139 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.4 mtp -117.73 -63.48 1.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 62.200000000000003 110.888 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -89.61 171.24 9.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 74.319999999999993 110.809 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -103.44 174.04 6.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.102 -0.499 . . . . 73.120000000000005 110.841 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.458 ' CE1' ' HH ' ' A' ' 30' ' ' TYR . 62.2 m-70 -110.09 132.66 53.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.49 . . . . 72.120000000000005 110.837 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 2.1 t -90.26 13.87 14.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 44.520000000000003 110.896 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -140.33 156.9 46.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 62.240000000000002 110.816 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -92.49 155.3 42.37 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 121.565 0.697 . . . . 51.420000000000002 110.883 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 162.23 42.87 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.659 2.239 . . . . 74.25 112.327 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.36 79.93 1.73 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 74.430000000000007 110.829 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.0 mt -46.35 -23.24 0.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 71.219999999999999 110.955 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.59 -40.93 72.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 45.130000000000003 111.111 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -80.44 -40.5 12.94 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.754 -0.736 . . . . 64.310000000000002 112.48 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.1 tp -65.77 -39.63 91.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.78 0.324 . . . . 54.140000000000001 110.909 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -63.64 -31.95 73.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 74.510000000000005 110.9 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.67 -31.57 72.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.491 . . . . 75.340000000000003 111.097 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.8 mt -79.35 -28.26 42.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 73.219999999999999 110.934 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.687 ' HG2' HD21 ' A' ' 14' ' ' LEU . 69.5 mtp180 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 74.450000000000003 110.84 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.95 HD21 HD11 ' A' ' 23' ' ' LEU . 20.7 tp . . . . . 0 CA--C 1.526 0.037 0 CA-C-O 120.833 0.349 . . . . 72.209999999999994 110.877 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -107.31 151.67 25.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 65.010000000000005 110.849 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.613 ' CE2' HD13 ' A' ' 23' ' ' LEU . 72.1 m-85 -137.22 172.96 12.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.121 -0.49 . . . . 75.450000000000003 110.83 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.493 HD12 HD21 ' A' ' 29' ' ' LEU . 16.6 mt -147.81 174.1 12.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.088 -0.506 . . . . 75.450000000000003 110.937 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 62.350000000000001 110.816 179.94 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.407 ' CD ' ' O ' ' A' ' 14' ' ' LEU . 12.1 tpt180 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.786 0.327 . . . . 54.219999999999999 110.916 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -107.42 158.67 16.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 62.43 110.936 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.95 HD11 HD21 ' A' ' 11' ' ' LEU . 13.1 tp -124.11 115.96 22.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.466 . . . . 74.209999999999994 110.935 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.3 t -90.35 115.51 29.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 64.010000000000005 111.086 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.877 ' CG ' HD13 ' A' ' 63' ' ' ILE . 29.7 t60 -153.49 132.77 12.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 74.310000000000002 110.809 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 60.02 33.16 21.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 75.439999999999998 110.967 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.8 m 65.43 29.23 11.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.119 -0.491 . . . . 52.539999999999999 110.909 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -130.74 -174.68 3.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.109 -0.496 . . . . 63.520000000000003 110.848 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.493 HD21 HD12 ' A' ' 14' ' ' LEU . 9.8 mt -138.86 132.7 30.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.108 -0.496 . . . . 74.049999999999997 110.967 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.522 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -125.96 166.92 16.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.19 -0.459 . . . . 75.099999999999994 110.973 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -126.29 126.42 43.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.132 -0.486 . . . . 73.010000000000005 110.843 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -45.18 108.58 0.13 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.151 -0.477 . . . . 45.409999999999997 110.878 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -82.89 -53.41 5.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 71.299999999999997 110.927 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.466 ' HD3' ' CD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -159.16 178.8 9.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.083 -0.508 . . . . 74.310000000000002 110.923 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -130.52 128.61 41.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.446 . . . . 63.539999999999999 111.068 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.41 19.91 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 75.140000000000001 111.07 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 90.86 -49.65 3.1 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.731 -0.747 . . . . 51.229999999999997 112.472 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -111.32 -18.83 12.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.922 0.391 . . . . 71.209999999999994 110.866 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.464 ' HB3' ' CG2' ' A' ' 57' ' ' ILE . 9.9 mtmm -123.02 170.64 9.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.236 -0.438 . . . . 73.540000000000006 110.938 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.441 ' O ' ' CD1' ' A' ' 42' ' ' TRP . 4.7 t -133.53 119.13 33.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.236 -0.438 . . . . 65.530000000000001 111.114 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.466 ' CD1' ' HD3' ' A' ' 34' ' ' LYS . 2.9 m-85 -75.79 150.3 37.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.113 -0.494 . . . . 74.420000000000002 110.922 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.734 ' CD1' HG23 ' A' ' 58' ' ' THR . 75.3 m95 -142.92 121.96 12.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.106 -0.497 . . . . 64.299999999999997 110.892 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.463 ' SD ' ' NE2' ' A' ' 47' ' ' GLN . 16.3 ptt? -106.26 136.06 46.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.239 -0.437 . . . . 44.25 110.877 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.6 t -50.4 113.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 74.140000000000001 110.924 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.43 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 20.7 ptt-85 -44.66 -35.16 2.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 74.230000000000004 110.927 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.69 44.31 0.62 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 74.420000000000002 110.902 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.463 ' NE2' ' SD ' ' A' ' 43' ' ' MET . 24.6 pt20 -88.77 -26.18 21.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 75.439999999999998 110.914 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.77 -30.72 12.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 55.310000000000002 111.106 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 49' ' ' ARG . 4.5 ttp-105 -89.04 -62.34 1.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 70.040000000000006 110.855 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.5 mt -90.37 20.31 4.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 62.210000000000001 110.867 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 36.72 36.88 0.19 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.721 -0.752 . . . . 44.119999999999997 112.512 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.7 t -89.33 120.67 30.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.791 0.329 . . . . 74.439999999999998 110.877 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 40.8 mmm-85 -98.75 13.75 31.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.456 . . . . 73.230000000000004 110.857 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.507 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 23.2 t -61.26 108.21 0.88 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 74.540000000000006 110.94 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.43 ' CB ' ' CZ ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -111.08 164.33 12.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 70.010000000000005 110.868 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.735 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -157.23 159.93 38.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.420000000000002 111.13 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.464 ' CG2' ' HB3' ' A' ' 39' ' ' LYS . 74.6 mt -123.98 128.49 74.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.234 -0.439 . . . . 72.310000000000002 111.16 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.734 HG23 ' CD1' ' A' ' 42' ' ' TRP . 30.0 p -101.29 144.21 30.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 54.340000000000003 111.14 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.56 111.02 6.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 73.430000000000007 110.88 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 68.73 -94.77 0.36 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.717 -0.754 . . . . 64.319999999999993 112.505 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.68 7.28 5.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.832 0.348 . . . . 75.129999999999995 110.894 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -112.41 178.82 4.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 64.109999999999999 110.872 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.877 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.2 tt -145.74 157.87 12.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 73.239999999999995 111.172 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.735 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 2.7 ttp -135.31 140.66 45.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 54.049999999999997 110.804 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.1 t -106.37 143.22 17.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 62.130000000000003 111.162 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.0 mtp -117.96 -55.21 2.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 74.439999999999998 110.897 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -110.75 144.91 38.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 74.310000000000002 110.828 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.3 p -75.39 168.71 19.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 74.439999999999998 110.783 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.507 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 72.6 m-70 -104.5 132.75 50.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.5 . . . . 74.049999999999997 110.833 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.6 t -86.21 11.95 10.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 55.43 110.853 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 25.9 p80 -140.2 154.96 47.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 74.450000000000003 110.858 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -89.52 152.36 47.17 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.67 0.747 . . . . 72.540000000000006 110.878 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 159.58 52.86 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.665 2.243 . . . . 71.219999999999999 112.365 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.48 85.68 2.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 44.219999999999999 110.892 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.2 mt -52.34 -18.17 1.48 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 65.420000000000002 110.918 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.6 -52.28 13.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 73.510000000000005 111.099 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -70.98 -34.96 64.94 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.666 -0.778 . . . . 21.239999999999998 112.571 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.1 tp -68.55 -42.04 78.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.802 0.334 . . . . 73.329999999999998 110.937 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.57 -40.81 97.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 64.319999999999993 110.891 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.95 -28.45 57.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.239999999999995 111.102 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.2 mt -81.59 -29.65 33.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.400000000000006 110.943 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 41.4 mtp180 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 61.420000000000002 110.901 179.89 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.758 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 23.7 tp . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.817 0.342 . . . . 73.400000000000006 110.909 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -91.66 136.71 32.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 71.329999999999998 110.857 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.758 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 68.3 m-85 -136.82 169.65 17.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 73.430000000000007 110.898 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.418 HD21 ' HG2' ' A' ' 82' ' ' ARG . 12.8 mt -143.92 120.99 11.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 64.299999999999997 110.931 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 62.409999999999997 110.881 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 ttp180 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.798 0.333 . . . . 74.030000000000001 110.852 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -129.25 166.04 20.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 74.230000000000004 110.88 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.636 HD11 HD21 ' A' ' 11' ' ' LEU . 5.0 tp -133.18 113.42 12.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.171 -0.468 . . . . 52.539999999999999 110.91 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.4 t -88.06 119.53 35.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 65.239999999999995 111.164 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.646 ' CG ' HD13 ' A' ' 63' ' ' ILE . 4.7 t60 -155.85 132.38 10.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 75.319999999999993 110.821 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 58.19 36.72 26.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.282 -0.417 . . . . 64.5 110.851 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m 62.23 26.07 15.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 53.25 110.822 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -126.29 -178.63 4.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 74.040000000000006 110.923 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.528 ' CD1' ' CZ ' ' A' ' 45' ' ' ARG . 67.8 mt -132.75 136.19 46.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.477 . . . . 72.420000000000002 110.926 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.511 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -130.46 159.46 36.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 70.209999999999994 110.878 -179.944 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.458 ' NE ' ' HA ' ' A' ' 45' ' ' ARG . 3.0 mtt180 -113.96 136.81 52.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 75.439999999999998 110.881 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.4 tttt -61.28 108.67 0.96 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 64.519999999999996 110.892 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -81.01 -60.06 2.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.278 -0.419 . . . . 71.109999999999999 110.89 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 26.8 pttt -153.0 177.71 10.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 74.540000000000006 110.888 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -138.49 117.57 12.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.441 . . . . 64.120000000000005 111.134 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.8 91.75 4.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 34.119999999999997 111.142 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.25 -85.84 0.1 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.73 -0.748 . . . . 74.230000000000004 112.539 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -117.26 0.17 12.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.91 0.386 . . . . 74.129999999999995 110.879 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.623 ' HE3' HG21 ' A' ' 57' ' ' ILE . 55.8 mtpt -102.94 156.77 17.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 74.439999999999998 110.893 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.5 t -138.25 117.6 14.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.267 -0.424 . . . . 42.039999999999999 111.126 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.786 ' CE2' HD11 ' A' ' 57' ' ' ILE . 9.1 m-85 -82.07 146.64 29.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 74.150000000000006 110.952 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.559 ' CG ' HD22 ' A' ' 23' ' ' LEU . 71.8 m95 -137.3 159.64 41.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.13 -0.486 . . . . 75.219999999999999 110.904 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.1 ptt? -143.64 126.13 15.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 72.310000000000002 110.908 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -38.16 114.11 0.33 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.271 -0.422 . . . . 62.32 110.871 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.528 ' CZ ' ' CD1' ' A' ' 29' ' ' LEU . 20.2 ptt180 -52.64 -22.57 5.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 71.040000000000006 110.864 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.56 43.32 1.02 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 72.420000000000002 110.867 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -85.86 -35.51 20.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.456 . . . . 72.329999999999998 110.885 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.6 -9.3 27.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 45.149999999999999 111.103 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 ttm-85 -98.29 -54.7 2.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 74.239999999999995 110.864 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.3 mt -110.05 26.46 10.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 71.239999999999995 110.886 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.14 47.38 4.33 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.757 -0.735 . . . . 64.420000000000002 112.494 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.1 t -94.94 147.08 23.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.747 0.308 . . . . 72.140000000000001 110.918 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.406 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -132.07 26.65 4.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 74.439999999999998 110.857 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.684 ' HG ' ' CE1' ' A' ' 69' ' ' HIS . 47.0 t -78.07 109.53 12.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 73.510000000000005 110.828 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.406 ' NH1' ' HB2' ' A' ' 53' ' ' ARG . 9.7 mpt_? -103.75 158.29 16.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.329999999999998 110.915 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -149.13 161.39 42.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 75.439999999999998 111.064 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.786 HD11 ' CE2' ' A' ' 41' ' ' TYR . 40.6 mt -127.19 121.57 57.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 55.009999999999998 111.12 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.5 p -102.58 143.71 31.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.49 . . . . 73.129999999999995 111.127 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -129.25 87.05 2.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.243 -0.435 . . . . 70.209999999999994 110.944 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.81 -82.26 1.09 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.742 -0.742 . . . . 73.040000000000006 112.509 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -127.75 9.59 6.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.709 0.29 . . . . 65.409999999999997 110.794 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -111.68 170.49 8.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.169 -0.468 . . . . 63.030000000000001 110.896 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.646 HD13 ' CG ' ' A' ' 25' ' ' HIS . 5.7 tt -148.13 145.46 18.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 72.209999999999994 111.139 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.49 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 4.0 mpp? -132.7 133.31 43.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 71.329999999999998 110.897 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.2 t -104.45 130.0 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.416 . . . . 73.230000000000004 111.082 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.443 ' CE ' HD12 ' A' ' 57' ' ' ILE . 10.4 mmt -102.46 -62.82 1.22 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 61.299999999999997 110.858 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.21 172.93 8.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.272 -0.422 . . . . 72.409999999999997 110.842 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -106.24 168.07 9.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 53.0 110.919 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.684 ' CE1' ' HG ' ' A' ' 54' ' ' SER . 48.0 m-70 -105.19 130.98 53.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 72.319999999999993 110.899 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.9 t -88.51 11.93 15.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.208 -0.451 . . . . 41.539999999999999 110.877 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -137.48 161.0 37.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 63.210000000000001 110.827 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -97.22 151.95 37.99 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.55 0.691 . . . . 75.409999999999997 110.963 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 154.08 68.29 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.699 2.266 . . . . 61.509999999999998 112.369 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -131.36 79.67 1.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.182 -0.463 . . . . 72.010000000000005 110.845 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.6 mt -44.18 -23.43 0.1 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 73.219999999999999 110.868 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.99 -47.82 67.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.451 . . . . 61.140000000000001 111.138 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.52 -35.58 59.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.704 -0.76 . . . . 73.040000000000006 112.548 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -71.01 -35.35 72.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.727 0.299 . . . . 62.130000000000003 110.906 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -74.6 -25.05 59.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 75.409999999999997 110.879 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.93 -31.09 69.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 74.439999999999998 111.087 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.0 mt -86.39 -32.05 21.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.266 -0.424 . . . . 54.020000000000003 110.92 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.418 ' HG2' HD21 ' A' ' 14' ' ' LEU . 3.6 mtp-105 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 75.439999999999998 110.813 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.62 HD21 HD11 ' A' ' 23' ' ' LEU . 14.0 tp . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.755 0.312 . . . . 40.109999999999999 110.95 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.593 ' OE2' HG11 ' A' ' 24' ' ' VAL . 31.8 tt0 -90.5 139.94 30.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 61.219999999999999 110.883 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.482 ' CZ ' ' HB3' ' A' ' 11' ' ' LEU . 68.7 m-85 -138.88 169.53 17.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.13 -0.487 . . . . 71.420000000000002 110.817 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.851 HD21 ' HG3' ' A' ' 82' ' ' ARG . 14.8 mt -142.3 162.01 36.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 71.129999999999995 110.873 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 45.4 mtp180 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 73.439999999999998 110.911 179.938 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.7 ttm180 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.897 0.38 . . . . 70.549999999999997 110.849 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -116.88 157.8 25.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 75.120000000000005 110.841 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.62 HD11 HD21 ' A' ' 11' ' ' LEU . 13.6 tp -120.84 117.08 26.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 75.239999999999995 110.853 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.593 HG11 ' OE2' ' A' ' 12' ' ' GLU . 93.7 t -92.31 117.33 35.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 61.210000000000001 111.132 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.687 ' CG ' HD13 ' A' ' 63' ' ' ILE . 5.7 t60 -153.52 127.76 9.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.462 . . . . 74.549999999999997 110.828 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 61.23 41.63 13.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 74.200000000000003 110.884 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.4 m 54.84 35.56 24.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 60.310000000000002 110.848 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.412 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 19.1 m-85 -133.03 -176.76 4.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 62.409999999999997 110.91 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.619 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 56.5 mt -133.66 132.66 40.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 63.130000000000003 110.951 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.517 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -128.43 169.06 14.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 74.450000000000003 110.921 -179.925 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HB3' ' CZ ' ' A' ' 31' ' ' ARG . 2.1 mtp-105 -129.69 142.99 50.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 73.349999999999994 110.889 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -64.13 109.02 1.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 75.109999999999999 110.903 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -83.06 -55.08 4.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 60.130000000000003 110.853 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.0 pttt -153.36 -176.13 5.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 62.030000000000001 110.927 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.75 128.05 22.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 74.099999999999994 111.129 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' A' ' 38' ' ' GLU . . . -114.07 -177.12 3.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 63.340000000000003 111.053 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -42.7 95.31 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.678 -0.772 . . . . 35.149999999999999 112.449 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 36' ' ' ALA . 7.0 mp0 55.6 42.65 29.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.94 0.4 . . . . 74.099999999999994 110.873 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.527 ' HD2' HG21 ' A' ' 57' ' ' ILE . 39.6 mtmt -150.12 160.68 43.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.218 -0.446 . . . . 62.420000000000002 110.833 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.5 t -138.94 121.0 17.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 62.140000000000001 111.133 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -85.3 139.42 31.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 75.099999999999994 110.903 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.545 ' CG ' HD22 ' A' ' 23' ' ' LEU . 74.1 m95 -129.55 157.04 43.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.131 -0.486 . . . . 74.329999999999998 110.924 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 20.3 ptt? -144.07 136.25 26.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 72.409999999999997 110.819 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.4 t -46.39 114.95 0.9 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 61.420000000000002 110.832 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.619 ' CZ ' HD13 ' A' ' 29' ' ' LEU . 19.0 ptt180 -55.18 -21.43 13.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.118 -0.492 . . . . 72.510000000000005 110.883 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.33 36.6 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 74.019999999999996 110.892 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -80.54 -36.45 33.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 71.140000000000001 110.927 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.43 -15.33 25.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.185 -0.461 . . . . 64.400000000000006 111.046 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.5 ttm180 -98.79 -62.12 1.28 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 73.010000000000005 110.806 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.437 HD13 ' CG ' ' A' ' 71' ' ' HIS . 95.4 mt -97.28 26.84 4.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 72.299999999999997 110.939 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.02 47.72 1.03 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.753 -0.736 . . . . 70.230000000000004 112.538 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 7.6 t -95.65 148.96 21.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.771 0.32 . . . . 74.120000000000005 110.895 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 27.7 mmm180 -124.83 8.25 8.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 75.439999999999998 110.937 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.462 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 22.8 t -58.36 147.13 32.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 50.409999999999997 110.845 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 46.9 mtt180 -146.98 164.2 33.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 72.129999999999995 110.862 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.675 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -152.43 153.81 34.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 73.019999999999996 111.149 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.527 HG21 ' HD2' ' A' ' 39' ' ' LYS . 85.8 mt -119.25 126.22 75.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.23 -0.441 . . . . 62.329999999999998 111.058 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.544 HG22 HG13 ' A' ' 63' ' ' ILE . 49.7 p -103.05 144.69 30.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 72.099999999999994 111.144 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -133.81 87.11 2.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 73.349999999999994 110.925 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.9 -86.62 1.55 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 63.240000000000002 112.472 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -128.11 -5.59 5.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.75 0.31 . . . . 72.120000000000005 110.832 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.1 mtm105 -96.4 -178.32 4.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 73.209999999999994 110.885 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.687 HD13 ' CG ' ' A' ' 25' ' ' HIS . 8.5 tt -150.63 156.44 6.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 74.430000000000007 111.156 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.675 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 1.6 ttp -143.26 144.78 32.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 72.5 110.892 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 86.3 t -102.08 148.64 7.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.227 -0.442 . . . . 74.030000000000001 111.14 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 19.1 mtm -119.23 -62.15 1.55 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 71.109999999999999 110.899 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.9 mtt85 -103.11 164.31 11.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 72.299999999999997 110.921 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.2 m -90.86 175.34 7.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 75.25 110.903 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.462 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 65.1 m-70 -112.88 134.6 54.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 73.109999999999999 110.895 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.6 m -92.0 13.42 18.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.465 . . . . 53.210000000000001 110.956 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.437 ' CG ' HD13 ' A' ' 50' ' ' LEU . 31.0 p80 -139.67 166.3 24.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.133 -0.485 . . . . 75.129999999999995 110.876 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -95.66 153.72 39.34 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.635 0.731 . . . . 71.439999999999998 110.963 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.412 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.74 152.7 69.48 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.73 2.286 . . . . 71.25 112.312 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -114.37 75.67 0.94 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 74.450000000000003 110.912 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.6 mt -49.56 -19.76 0.64 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.242 -0.435 . . . . 71.310000000000002 110.927 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.02 -50.01 6.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 50.140000000000001 111.073 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.76 -34.01 88.78 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.744 -0.741 . . . . 64.430000000000007 112.472 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -73.65 -44.49 56.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.823 0.344 . . . . 74.409999999999997 111.0 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.64 -26.76 68.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 71.530000000000001 110.875 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.82 -55.57 14.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 72.5 111.129 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.5 mt -46.51 -49.32 18.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 54.329999999999998 110.946 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.851 ' HG3' HD21 ' A' ' 14' ' ' LEU . 9.1 mtt-85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 74.319999999999993 110.881 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.807 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 18.0 tp . . . . . 0 C--O 1.23 0.06 0 CA-C-O 120.837 0.351 . . . . 71.25 110.875 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -110.89 140.44 45.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.158 -0.474 . . . . 72.349999999999994 110.899 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.807 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 8.6 m-85 -137.33 172.96 12.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.474 . . . . 72.310000000000002 110.89 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.907 HD21 ' HG3' ' A' ' 82' ' ' ARG . 3.7 mt -148.04 160.23 43.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.19 -0.459 . . . . 75.150000000000006 110.906 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 65.209999999999994 110.848 179.991 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.784 0.326 . . . . 62.229999999999997 110.892 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -123.95 160.89 26.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 74.209999999999994 110.928 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.796 HD11 HD21 ' A' ' 11' ' ' LEU . 10.9 tp -122.56 118.69 28.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.205 -0.452 . . . . 72.140000000000001 110.918 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.684 ' CG2' HD12 ' A' ' 14' ' ' LEU . 24.2 t -94.79 108.22 20.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 63.450000000000003 111.166 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.832 ' CG ' HD13 ' A' ' 63' ' ' ILE . 50.1 t60 -145.12 134.14 22.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 73.299999999999997 110.86 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 59.54 33.18 22.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 71.140000000000001 110.94 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.1 m 65.3 25.39 12.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 75.340000000000003 110.854 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.497 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 15.4 m-85 -127.84 179.18 5.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 72.239999999999995 110.875 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.485 HD11 HD12 ' A' ' 81' ' ' LEU . 11.2 mt -128.37 133.14 48.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.144 -0.48 . . . . 64.510000000000005 110.931 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.505 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.1 m-85 -124.57 164.19 20.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.244 -0.435 . . . . 75.040000000000006 110.906 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.2 mtp180 -123.23 134.34 54.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 74.129999999999995 110.85 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 34.4 tttm -59.93 110.02 1.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 72.439999999999998 110.84 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -85.0 -54.08 4.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 73.319999999999993 110.916 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.415 ' CG ' ' HB2' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -146.55 171.26 15.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 72.5 110.881 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -133.39 115.01 14.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 64.030000000000001 111.125 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.408 ' O ' ' C ' ' A' ' 37' ' ' GLY . . . -89.14 -175.62 4.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 51.039999999999999 111.159 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.408 ' C ' ' O ' ' A' ' 36' ' ' ALA . . . -37.59 -72.48 0.17 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.761 -0.733 . . . . 24.149999999999999 112.444 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -125.76 39.78 3.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.945 0.402 . . . . 75.439999999999998 110.933 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.66 ' HE3' HG21 ' A' ' 57' ' ' ILE . 40.9 mtpt -145.21 167.9 21.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 71.040000000000006 110.89 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 t -138.38 126.15 28.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 71.109999999999999 111.08 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.415 ' HB2' ' CG ' ' A' ' 34' ' ' LYS . 2.7 m-85 -90.49 139.56 30.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 71.319999999999993 110.967 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -132.99 167.59 20.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 74.329999999999998 110.894 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -152.47 130.72 12.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 72.310000000000002 110.912 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.404 ' C ' ' N ' ' A' ' 46' ' ' ASP . 2.0 t -44.35 106.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 74.430000000000007 110.869 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.5 ptt85 -44.05 -23.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 73.540000000000006 110.839 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.404 ' N ' ' C ' ' A' ' 44' ' ' CYS . 2.0 m-20 -85.31 31.31 0.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 74.129999999999995 110.834 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.406 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 3.9 tm0? -82.85 -23.63 33.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 73.25 110.921 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.62 -25.84 14.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 55.219999999999999 111.081 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.36 -52.8 3.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 73.540000000000006 110.806 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.438 HD13 ' CG ' ' A' ' 71' ' ' HIS . 54.3 mt -94.39 9.43 38.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 74.400000000000006 110.91 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 46.88 32.65 6.17 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.688 -0.768 . . . . 50.299999999999997 112.537 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 36.4 t -80.7 122.23 26.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.8 0.333 . . . . 62.420000000000002 110.88 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 26.1 mmm180 -101.5 37.21 1.85 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 74.329999999999998 110.869 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.473 ' HG ' ' CD2' ' A' ' 69' ' ' HIS . 13.1 t -88.77 119.65 29.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 73.540000000000006 110.862 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -117.02 146.92 42.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 72.129999999999995 110.88 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.639 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -139.4 164.85 28.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 54.229999999999997 111.029 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.66 HG21 ' HE3' ' A' ' 39' ' ' LYS . 61.4 mt -132.0 117.39 33.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.245 -0.434 . . . . 75.530000000000001 111.174 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.583 HG22 HG13 ' A' ' 63' ' ' ILE . 23.7 p -102.73 144.55 30.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 73.0 111.168 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.72 109.12 3.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 71.200000000000003 110.901 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.23 -102.86 2.65 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.818 -0.706 . . . . 64.409999999999997 112.505 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -127.51 4.78 6.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.723 0.297 . . . . 73.219999999999999 110.786 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.4 mtm180 -110.68 -175.57 2.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 74.109999999999999 110.8 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.832 HD13 ' CG ' ' A' ' 25' ' ' HIS . 18.7 tt -150.21 157.27 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 73.530000000000001 111.11 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.639 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 3.2 ttp -134.83 141.57 46.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 65.329999999999998 110.838 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 19.3 t -111.91 138.44 40.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.454 . . . . 64.25 111.163 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.1 mtt -105.65 -56.84 2.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 73.329999999999998 110.887 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.459 ' HD3' ' N ' ' A' ' 68' ' ' SER . 0.0 OUTLIER -118.74 144.48 46.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 71.239999999999995 110.835 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.459 ' N ' ' HD3' ' A' ' 67' ' ' ARG . 14.2 t -69.25 -179.6 1.65 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.479 . . . . 74.299999999999997 110.898 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.473 ' CD2' ' HG ' ' A' ' 54' ' ' SER . 20.5 m-70 -109.27 145.76 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 74.319999999999993 110.852 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.7 t -93.4 6.19 49.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 71.019999999999996 110.848 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.438 ' CG ' HD13 ' A' ' 50' ' ' LEU . 26.2 p80 -137.32 165.63 25.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 52.530000000000001 110.911 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -100.42 150.31 36.84 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.61 0.719 . . . . 75.239999999999995 110.913 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.497 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.5 Cg_endo -69.74 158.86 55.53 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.664 2.243 . . . . 63.310000000000002 112.292 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -139.81 90.54 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.472 . . . . 63.140000000000001 110.871 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.8 mt -55.82 -14.23 2.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.232 -0.44 . . . . 70.430000000000007 110.909 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.4 -49.06 58.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 72.209999999999994 111.07 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.99 -32.94 34.57 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.746 -0.74 . . . . 65.200000000000003 112.487 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.427 HD11 ' HE ' ' A' ' 82' ' ' ARG . 7.3 tp -67.79 -39.93 83.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 62.219999999999999 110.925 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -63.4 -24.8 68.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.134 -0.484 . . . . 73.400000000000006 110.91 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.22 70.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 74.239999999999995 111.097 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.485 HD12 HD11 ' A' ' 29' ' ' LEU . 50.3 mt -63.85 -51.67 63.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 73.230000000000004 110.909 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.907 ' HG3' HD21 ' A' ' 14' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 74.409999999999997 110.953 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.597 HD22 ' HB ' ' A' ' 63' ' ' ILE . 13.5 tp . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.765 0.316 . . . . 72.439999999999998 110.924 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -112.59 140.74 47.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 75.540000000000006 110.971 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.568 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 70.3 m-85 -139.84 172.91 12.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 61.539999999999999 110.887 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.672 HD12 ' CG2' ' A' ' 24' ' ' VAL . 6.3 mt -151.78 162.5 40.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.132 -0.486 . . . . 75.430000000000007 110.841 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 73.430000000000007 110.842 179.915 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.436 ' NE ' ' O ' ' A' ' 14' ' ' LEU . 5.9 tpt180 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.85 0.357 . . . . 71.420000000000002 110.88 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -105.43 160.53 15.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 72.530000000000001 110.925 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.566 HD13 ' CE1' ' A' ' 13' ' ' PHE . 20.3 tp -119.66 125.27 48.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 71.510000000000005 110.936 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.672 ' CG2' HD12 ' A' ' 14' ' ' LEU . 20.9 t -106.15 123.0 60.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 65.230000000000004 111.162 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.788 ' CG ' HD13 ' A' ' 63' ' ' ILE . 64.9 t60 -153.02 138.77 17.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.138 -0.483 . . . . 75.329999999999998 110.877 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 54.82 24.68 5.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 74.340000000000003 110.878 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m 75.24 26.63 1.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.487 . . . . 44.509999999999998 110.903 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -124.94 -176.07 3.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 74.319999999999993 110.899 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.645 HD13 ' NE ' ' A' ' 45' ' ' ARG . 56.0 mt -128.98 147.56 50.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 65.439999999999998 110.888 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.602 ' CD1' ' C ' ' A' ' 29' ' ' LEU . 1.0 OUTLIER -144.77 173.75 11.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 65.209999999999994 110.915 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -135.59 141.91 45.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.126 -0.488 . . . . 72.310000000000002 110.887 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.2 tttm -64.35 115.51 5.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 73.239999999999995 110.882 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -92.91 -57.18 2.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 71.340000000000003 110.926 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -150.6 179.04 8.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.487 . . . . 53.109999999999999 110.951 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -136.88 117.73 14.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 54.020000000000003 111.177 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.57 -175.57 3.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 62.039999999999999 111.04 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -48.97 94.36 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.72 -0.752 . . . . 71.239999999999995 112.494 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 62.51 34.59 15.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.934 0.397 . . . . 73.230000000000004 110.887 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -145.33 158.03 43.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 74.129999999999995 110.885 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.1 t -138.25 114.17 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 62.409999999999997 111.114 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -78.69 146.07 34.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 74.319999999999993 110.914 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.545 ' CD2' HD22 ' A' ' 23' ' ' LEU . 69.5 m95 -135.88 151.85 50.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.079 -0.509 . . . . 62.310000000000002 110.905 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -134.93 129.82 34.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 65.230000000000004 110.895 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.6 t -42.81 116.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 74.450000000000003 110.859 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.645 ' NE ' HD13 ' A' ' 29' ' ' LEU . 18.3 ptt180 -55.14 -20.55 10.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 60.32 110.874 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.54 36.44 0.54 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 65.0 110.854 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -88.43 -18.88 27.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.143 -0.48 . . . . 74.519999999999996 110.913 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.12 -31.05 12.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 64.010000000000005 111.144 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.0 ttm-85 -95.05 -57.36 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 71.230000000000004 110.811 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.475 ' O ' ' N ' ' A' ' 52' ' ' CYS . 22.6 mt -95.61 22.65 6.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 63.200000000000003 110.915 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.94 29.66 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.687 -0.768 . . . . 73.230000000000004 112.466 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.475 ' N ' ' O ' ' A' ' 50' ' ' LEU . 4.7 t -75.76 127.66 33.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.844 0.354 . . . . 74.209999999999994 110.852 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.33 -10.92 17.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 74.319999999999993 110.844 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 m -39.32 128.26 1.8 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.229 -0.441 . . . . 51.32 110.86 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.401 ' C ' ' HG3' ' A' ' 66' ' ' MET . 16.0 mtt85 -123.82 166.03 16.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 74.420000000000002 110.842 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.476 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -149.72 156.51 41.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 75.049999999999997 111.075 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 91.0 mt -125.42 122.49 62.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 71.109999999999999 111.121 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.675 HG22 HG13 ' A' ' 63' ' ' ILE . 34.3 p -101.1 142.43 32.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 74.319999999999993 111.128 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.95 87.17 2.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 73.129999999999995 110.95 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.45 -85.23 1.56 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.721 -0.752 . . . . 71.129999999999995 112.486 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.89 -1.24 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.771 0.32 . . . . 63.310000000000002 110.855 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.444 ' CZ ' ' HB3' ' A' ' 62' ' ' ARG . 1.4 mtp-105 -102.71 174.39 5.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 62.32 110.888 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.788 HD13 ' CG ' ' A' ' 25' ' ' HIS . 4.9 tt -145.06 154.14 14.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 72.010000000000005 111.114 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.476 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 9.4 ttp -138.16 142.66 40.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.149 -0.478 . . . . 75.420000000000002 110.882 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.1 t -95.14 145.03 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 74.329999999999998 111.067 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.401 ' HG3' ' C ' ' A' ' 55' ' ' ARG . 31.0 mtp -104.77 -61.04 1.51 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.088 -0.505 . . . . 74.310000000000002 110.783 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -123.02 162.65 21.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 70.230000000000004 110.888 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.34 153.91 29.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 43.399999999999999 110.86 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -92.37 137.86 32.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.099 -0.5 . . . . 75.040000000000006 110.848 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 51.9 t -89.48 10.1 24.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 72.25 110.865 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.44 ' CB ' HD13 ' A' ' 50' ' ' LEU . 31.8 p80 -136.93 142.81 42.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 73.5 110.801 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -79.8 155.59 75.49 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.587 0.708 . . . . 74.230000000000004 110.914 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.66 155.86 65.14 Favored 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.743 2.295 . . . . 70.109999999999999 112.365 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -133.14 80.37 1.88 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 70.409999999999997 110.884 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.514 HD23 ' N ' ' A' ' 75' ' ' LEU . 3.4 mt -45.78 -23.85 0.31 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.234 -0.439 . . . . 74.120000000000005 110.848 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.57 -43.18 73.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 54.310000000000002 111.088 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -77.99 -36.8 30.94 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.753 -0.737 . . . . 70.030000000000001 112.465 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tp -69.64 -37.39 76.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.741 0.305 . . . . 75.209999999999994 110.94 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -68.98 -29.44 67.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 74.140000000000001 110.904 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.63 93.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.1 -0.5 . . . . 64.120000000000005 111.102 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 61.4 mt -67.98 -46.96 69.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.23 -0.441 . . . . 65.150000000000006 110.966 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.8 mtp-105 . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.791 179.97 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.615 HD21 HD11 ' A' ' 23' ' ' LEU . 28.8 tp . . . . . 0 N--CA 1.458 -0.036 0 CA-C-O 120.77 0.319 . . . . 73.230000000000004 110.951 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.464 ' OE1' HG11 ' A' ' 24' ' ' VAL . 41.3 tt0 -98.15 147.47 24.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.463 . . . . 73.200000000000003 110.858 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.537 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 52.3 m-85 -136.68 172.86 12.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 63.049999999999997 110.874 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.507 HD12 ' CG2' ' A' ' 24' ' ' VAL . 5.0 mt -147.51 158.29 43.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 72.450000000000003 110.923 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 73.120000000000005 110.876 179.939 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.6 ttt85 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.851 0.358 . . . . 74.439999999999998 110.915 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.556 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -100.99 170.73 8.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 73.0 110.855 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.615 HD11 HD21 ' A' ' 11' ' ' LEU . 4.3 tp -139.1 138.17 36.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 72.310000000000002 110.93 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.507 ' CG2' HD12 ' A' ' 14' ' ' LEU . 18.1 t -104.26 126.55 58.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 71.420000000000002 111.093 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.771 ' CG ' HD13 ' A' ' 63' ' ' ILE . 5.2 t60 -159.73 132.28 6.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.128 -0.487 . . . . 72.230000000000004 110.844 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 53.17 37.79 25.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 64.409999999999997 110.9 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 72.1 m 63.05 26.7 15.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 65.010000000000005 110.857 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -126.68 164.11 22.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 73.530000000000001 110.807 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.552 HD12 ' CZ ' ' A' ' 45' ' ' ARG . 62.6 mt -115.3 137.64 51.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 72.219999999999999 110.867 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.536 ' CE1' ' HB3' ' A' ' 25' ' ' HIS . 1.6 m-85 -127.16 168.02 15.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 71.409999999999997 110.995 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.556 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 12.4 mtp-105 -128.72 118.38 22.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 72.040000000000006 110.893 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.446 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 32.8 tttm -41.57 116.6 0.79 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.444 . . . . 70.239999999999995 110.836 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -91.5 -54.34 3.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.219 -0.446 . . . . 73.109999999999999 110.906 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.91 -178.19 6.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 74.239999999999995 110.894 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.89 135.19 20.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 60.119999999999997 111.13 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -104.81 36.49 2.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 53.32 111.076 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.25 -63.27 4.45 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.722 -0.751 . . . . 74.239999999999995 112.43 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -101.75 -26.87 13.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.964 0.411 . . . . 63.200000000000003 110.866 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.9 mtmp? -105.4 159.91 15.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.483 . . . . 75.310000000000002 110.86 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.4 t -137.57 116.75 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 74.439999999999998 111.179 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.557 ' CE2' HD11 ' A' ' 57' ' ' ILE . 3.4 m-85 -80.75 145.9 31.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 63.039999999999999 110.954 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.542 ' CD1' HG23 ' A' ' 58' ' ' THR . 77.1 m95 -137.29 148.7 46.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 71.030000000000001 110.874 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 12.2 ptt? -131.62 126.88 35.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 63.530000000000001 110.843 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -42.54 120.78 1.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 74.310000000000002 110.85 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.552 ' CZ ' HD12 ' A' ' 29' ' ' LEU . 19.8 ptt180 -53.02 -17.84 1.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 63.25 110.884 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.564 ' HB3' HD12 ' A' ' 50' ' ' LEU . 1.1 m-20 -87.88 17.45 4.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 73.439999999999998 110.903 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.41 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -78.49 -15.5 58.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.227 -0.442 . . . . 61.219999999999999 110.888 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.403 ' HB2' ' OE1' ' A' ' 47' ' ' GLN . . . -96.76 -32.85 11.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 63.439999999999998 111.05 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -98.38 -62.51 1.23 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 74.010000000000005 110.843 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.564 HD12 ' HB3' ' A' ' 46' ' ' ASP . 31.6 mt -83.12 15.45 2.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 52.109999999999999 110.922 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.61 33.54 1.55 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.789 -0.72 . . . . 71.510000000000005 112.429 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.405 ' N ' ' HA ' ' A' ' 47' ' ' GLN . 38.1 t -77.75 108.91 11.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.8 0.333 . . . . 75.140000000000001 110.92 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -84.35 12.56 6.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 74.310000000000002 110.856 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.1 t -60.22 113.41 2.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 75.450000000000003 110.874 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.6 mtm180 -119.34 137.94 53.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 75.540000000000006 110.867 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.64 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -126.6 160.43 30.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 74.420000000000002 111.132 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.557 HD11 ' CE2' ' A' ' 41' ' ' TYR . 31.6 mt -128.23 128.36 68.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 74.099999999999994 111.158 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.542 HG23 ' CD1' ' A' ' 42' ' ' TRP . 19.3 p -101.95 147.39 26.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 74.120000000000005 111.205 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -142.83 106.89 4.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 72.430000000000007 110.875 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 69.93 -92.86 0.39 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.744 -0.741 . . . . 75.010000000000005 112.51 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -128.82 6.91 5.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.772 0.32 . . . . 75.099999999999994 110.887 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 39.4 mtp85 -108.03 -175.93 2.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.287 -0.415 . . . . 74.120000000000005 110.867 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.771 HD13 ' CG ' ' A' ' 25' ' ' HIS . 9.8 tt -150.35 153.41 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 74.310000000000002 111.104 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.64 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 68.2 mtm -135.92 146.88 47.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 71.400000000000006 110.832 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.2 t -116.51 132.23 66.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 70.439999999999998 111.13 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mmm -92.02 -58.55 2.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 55.100000000000001 110.891 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -118.44 160.19 22.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 74.040000000000006 110.861 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.2 m -78.62 -179.71 6.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 61.100000000000001 110.76 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -108.26 139.83 42.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.105 -0.498 . . . . 60.420000000000002 110.814 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.1 t -94.52 15.91 16.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 54.140000000000001 110.922 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.458 ' CB ' HD13 ' A' ' 50' ' ' LEU . 24.3 p80 -145.25 150.89 37.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.144 -0.48 . . . . 71.530000000000001 110.826 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -81.07 152.43 71.32 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.579 0.704 . . . . 62.210000000000001 110.964 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 149.61 67.36 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.708 2.272 . . . . 73.109999999999999 112.372 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.33 81.42 1.89 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.271 -0.422 . . . . 51.210000000000001 110.837 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 34.7 mt -53.95 -23.48 13.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 73.519999999999996 110.971 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.0 -45.71 66.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 55.020000000000003 111.147 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.01 -31.38 43.41 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.728 -0.749 . . . . 53.210000000000001 112.519 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tp -70.68 -38.3 73.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.723 0.297 . . . . 71.549999999999997 110.911 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -68.55 -23.46 64.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.254 -0.43 . . . . 74.439999999999998 110.849 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.55 -44.57 86.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 41.399999999999999 111.077 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.2 mt -69.92 -50.35 42.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 75.209999999999994 110.885 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.433 ' HG3' HD11 ' A' ' 14' ' ' LEU . 50.3 mtp180 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 71.239999999999995 110.879 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.725 HD21 HD11 ' A' ' 23' ' ' LEU . 24.5 tp . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.703 0.287 . . . . 70.310000000000002 110.968 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 -101.24 152.87 20.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.212 -0.449 . . . . 61.109999999999999 110.942 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.696 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 61.6 m-85 -137.93 169.93 16.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 110.832 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.623 HD12 ' CG2' ' A' ' 24' ' ' VAL . 4.1 mt -145.08 165.21 28.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 53.340000000000003 110.956 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 71.329999999999998 110.899 179.872 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.5 tpt85 . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.831 0.348 . . . . 63.439999999999998 110.813 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.471 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -103.55 165.54 10.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 64.25 110.878 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.725 HD11 HD21 ' A' ' 11' ' ' LEU . 8.4 tp -130.4 135.13 47.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 53.200000000000003 110.946 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 1.022 HG11 ' NH2' ' A' ' 82' ' ' ARG . 68.0 t -101.85 116.92 46.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 73.329999999999998 111.072 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.643 ' CG ' HD13 ' A' ' 63' ' ' ILE . 10.7 t60 -152.83 127.03 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 70.209999999999994 110.874 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 59.89 43.43 14.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 72.200000000000003 110.867 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.438 ' OG ' ' CD2' ' A' ' 75' ' ' LEU . 1.4 t 56.89 20.11 5.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.122 -0.49 . . . . 74.019999999999996 110.88 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.411 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 20.1 m-85 -116.52 -177.38 3.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 74.209999999999994 110.928 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.45 HD12 ' HE ' ' A' ' 45' ' ' ARG . 65.8 mt -134.14 134.08 41.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 74.310000000000002 110.897 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.511 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -125.93 172.03 10.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 75.310000000000002 110.956 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.471 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 59.4 mtp180 -131.7 129.08 40.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 73.540000000000006 110.924 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.43 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 51.6 tttm -54.86 122.07 9.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 62.520000000000003 110.934 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -94.06 -54.81 3.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 64.349999999999994 110.903 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.05 164.57 37.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.5 . . . . 75.120000000000005 110.846 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.48 131.98 54.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.439 . . . . 72.450000000000003 111.096 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -101.97 37.13 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.288 -0.414 . . . . 74.319999999999993 111.12 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.98 -73.39 2.31 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.682 -0.771 . . . . 62.009999999999998 112.453 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -102.95 -11.28 18.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 72.430000000000007 110.9 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 27.5 mtmm -115.38 156.57 25.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 73.409999999999997 110.897 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.0 t -133.79 114.42 19.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 74.439999999999998 111.144 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -77.74 149.06 34.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 72.200000000000003 110.967 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.481 ' CD1' HG23 ' A' ' 58' ' ' THR . 77.2 m95 -139.84 165.21 27.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 75.519999999999996 110.952 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 19.4 ptt? -151.45 133.58 15.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 72.120000000000005 110.845 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.7 t -46.22 118.17 1.82 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 75.150000000000006 110.88 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.45 ' HE ' HD12 ' A' ' 29' ' ' LEU . 41.6 ptt85 -52.06 -23.89 5.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 73.310000000000002 110.878 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -81.98 12.34 4.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 71.430000000000007 110.788 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.415 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 5.3 tm0? -71.46 -17.45 62.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.184 -0.462 . . . . 75.150000000000006 110.931 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.15 -36.76 11.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 74.239999999999995 111.109 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.3 mtt85 -93.54 -62.75 1.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 71.340000000000003 110.886 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.417 ' O ' ' C ' ' A' ' 51' ' ' GLY . 39.7 mt -84.25 18.32 2.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.469 . . . . 64.209999999999994 110.849 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.48 38.63 0.29 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.771 -0.728 . . . . 71.209999999999994 112.497 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 32.7 t -78.2 102.32 7.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.819 0.342 . . . . 72.310000000000002 110.865 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -81.91 45.61 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 63.329999999999998 110.913 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.8 t -100.04 111.7 23.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 71.040000000000006 110.921 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -107.17 161.07 15.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 73.219999999999999 110.921 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.641 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -149.86 162.6 39.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.257 -0.428 . . . . 55.240000000000002 111.116 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 74.6 mt -134.26 125.34 47.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 74.219999999999999 111.151 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.481 HG23 ' CD1' ' A' ' 42' ' ' TRP . 32.2 p -101.58 150.84 22.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.451 . . . . 73.209999999999994 111.15 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -147.71 112.97 5.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 71.129999999999995 110.954 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 65.25 -92.75 0.15 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.796 -0.716 . . . . 71.439999999999998 112.558 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.94 2.49 5.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.811 0.338 . . . . 75.200000000000003 110.883 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.1 mtt85 -102.33 -175.31 2.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 73.420000000000002 110.796 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.643 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -151.0 156.35 6.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 72.519999999999996 111.118 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.641 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 49.3 mtm -136.49 149.05 47.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.451 . . . . 74.319999999999993 110.894 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.5 t -121.55 133.89 66.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 63.210000000000001 111.121 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.4 mtp -93.56 -63.43 1.2 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.14 -0.482 . . . . 61.329999999999998 110.834 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -112.82 167.95 10.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 71.450000000000003 110.854 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.5 m -84.99 -177.55 6.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 74.120000000000005 110.883 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -110.04 137.87 47.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 71.099999999999994 110.903 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.6 t -91.79 13.96 16.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 71.239999999999995 110.872 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 24.0 p80 -143.8 159.33 42.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 73.030000000000001 110.825 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.9 mm100 -90.83 153.87 45.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.609 0.719 . . . . 73.430000000000007 110.891 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.411 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.3 Cg_endo -69.83 139.46 40.04 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.716 2.277 . . . . 73.420000000000002 112.289 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 77' ' ' GLY . 13.1 t0 -101.27 79.35 1.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 74.049999999999997 110.874 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.438 ' CD2' ' OG ' ' A' ' 27' ' ' SER . 7.9 mt -46.88 -24.64 0.62 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 73.109999999999999 110.935 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.66 -26.29 19.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 73.340000000000003 111.124 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 74' ' ' ASP . . . -84.07 -46.62 5.84 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.738 -0.744 . . . . 74.049999999999997 112.496 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.4 tp -67.71 -35.63 79.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 73.329999999999998 110.914 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -72.26 -31.44 65.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.161 -0.472 . . . . 62.340000000000003 110.952 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.72 -44.88 95.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 55.25 111.123 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.6 mt -60.18 -41.38 92.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 70.299999999999997 110.978 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 1.022 ' NH2' HG11 ' A' ' 24' ' ' VAL . 10.7 mtt180 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.145 -0.48 . . . . 70.450000000000003 110.901 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.975 HD21 HD11 ' A' ' 23' ' ' LEU . 20.4 tp . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.701 0.286 . . . . 71.319999999999993 110.944 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -105.31 148.28 27.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 71.540000000000006 110.88 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -139.81 172.86 12.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.128 -0.487 . . . . 74.239999999999995 110.863 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.765 HD21 ' HG2' ' A' ' 82' ' ' ARG . 6.3 mt -150.65 118.51 6.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.138 -0.483 . . . . 64.140000000000001 110.926 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.5 mtp180 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.040000000000006 110.832 179.972 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.46 ' HD3' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.895 0.379 . . . . 74.409999999999997 110.825 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.46 ' N ' ' HD3' ' A' ' 21' ' ' ARG . 2.6 m-85 -126.32 157.48 38.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 73.540000000000006 110.9 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.975 HD11 HD21 ' A' ' 11' ' ' LEU . 15.7 tp -120.58 116.47 25.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.152 -0.476 . . . . 71.049999999999997 110.979 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.585 ' CG2' HD12 ' A' ' 14' ' ' LEU . 58.8 t -90.88 114.52 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 62.32 111.074 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.8 ' CG ' HD13 ' A' ' 63' ' ' ILE . 6.9 t60 -151.6 127.13 10.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.138 -0.483 . . . . 63.229999999999997 110.868 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 62.97 38.51 11.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 72.120000000000005 110.897 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 m 60.03 29.19 18.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.091 -0.504 . . . . 74.439999999999998 110.855 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -130.48 178.15 6.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 51.399999999999999 110.882 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.421 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 32.1 mt -130.43 132.76 45.88 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.093 -0.503 . . . . 65.530000000000001 110.883 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.523 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -127.28 167.53 16.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 52.420000000000002 110.907 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.2 mtp180 -126.96 138.92 53.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.119 -0.492 . . . . 74.420000000000002 110.856 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 25.2 tttm -59.51 116.76 4.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 75.099999999999994 110.884 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -91.63 -52.93 4.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 73.420000000000002 110.86 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.64 ' NZ ' ' CD2' ' A' ' 41' ' ' TYR . 1.8 pttm -160.53 177.84 10.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 74.219999999999999 110.862 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.33 120.02 14.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 52.43 111.026 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.27 38.16 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.481 . . . . 54.020000000000003 111.082 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 102.73 -89.13 0.7 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.728 -0.749 . . . . 51.219999999999999 112.468 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -96.72 -4.43 40.74 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.825 0.345 . . . . 72.140000000000001 110.823 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.419 ' HB2' ' HZ2' ' A' ' 39' ' ' LYS . 5.9 mtmp? -113.7 158.61 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 73.530000000000001 110.855 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 t -136.26 119.24 22.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 72.129999999999995 111.107 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.64 ' CD2' ' NZ ' ' A' ' 34' ' ' LYS . 3.3 m-85 -81.31 151.19 28.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 61.409999999999997 110.941 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.676 ' CD1' HG23 ' A' ' 58' ' ' THR . 75.4 m95 -141.49 146.32 36.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 73.530000000000001 110.912 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.7 ptt? -129.26 144.56 51.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 72.340000000000003 110.871 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -55.13 108.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.432 . . . . 70.230000000000004 110.887 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.421 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.9 ptt-85 -39.98 -30.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 74.329999999999998 110.9 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -77.88 51.91 0.99 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 71.109999999999999 110.849 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -75.49 -51.8 12.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.252 -0.431 . . . . 62.130000000000003 110.909 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -98.0 -13.9 20.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 64.219999999999999 111.064 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 mmt-85 -81.82 -61.15 2.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 74.109999999999999 110.906 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.3 mt -108.01 26.75 9.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 74.219999999999999 110.928 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 38.4 42.45 1.31 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.789 -0.72 . . . . 75.349999999999994 112.469 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.7 t -96.32 130.01 43.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.79 0.328 . . . . 74.340000000000003 110.88 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -111.83 17.78 19.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.474 . . . . 71.420000000000002 110.841 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.9 t -69.51 127.88 34.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 72.030000000000001 110.832 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -121.62 173.15 7.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 72.010000000000005 110.899 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.744 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -155.52 163.76 39.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.466 . . . . 60.32 111.108 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 97.7 mt -128.37 121.71 56.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 64.439999999999998 111.089 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.676 HG23 ' CD1' ' A' ' 42' ' ' TRP . 20.1 p -101.08 151.27 22.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 73.450000000000003 111.151 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.18 113.14 2.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.465 . . . . 72.129999999999995 110.866 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 73.48 -101.11 1.13 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.793 -0.718 . . . . 73.510000000000005 112.486 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -127.06 7.12 6.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.736 0.303 . . . . 75.230000000000004 110.861 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.06 -175.42 2.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 70.140000000000001 110.868 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.8 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.89 162.72 3.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 73.209999999999994 111.102 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.744 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 1.5 ttp -143.5 148.84 36.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 75.120000000000005 110.889 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.6 t -113.64 144.38 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.426 . . . . 71.200000000000003 111.093 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 14.3 mtp -104.67 -61.61 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 72.230000000000004 110.895 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 52.9 mtt-85 -111.44 170.73 7.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 73.409999999999997 110.892 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 80.6 p -88.88 -177.91 5.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 75.310000000000002 110.858 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -116.01 138.96 50.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.067 -0.515 . . . . 74.299999999999997 110.866 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 4.3 t -90.98 8.35 35.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 71.319999999999993 110.837 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 26.5 p80 -135.59 157.76 46.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 63.32 110.792 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -91.62 151.79 42.76 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.568 0.699 . . . . 62.439999999999998 110.878 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 150.24 67.73 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.682 2.255 . . . . 75.209999999999994 112.347 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.56 81.37 1.97 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.231 -0.44 . . . . 72.230000000000004 110.913 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.443 HD23 ' N ' ' A' ' 75' ' ' LEU . 6.0 mt -48.25 -28.28 2.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 70.510000000000005 110.96 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.64 77.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 71.519999999999996 111.143 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.98 -29.23 59.25 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.741 -0.742 . . . . 72.519999999999996 112.516 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.1 tp -76.72 -41.09 46.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.761 0.315 . . . . 54.240000000000002 110.914 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -75.52 -23.43 56.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 71.209999999999994 110.908 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.92 -18.4 47.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 63.039999999999999 111.067 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.0 mt -80.56 -41.48 24.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 73.5 110.884 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.765 ' HG2' HD21 ' A' ' 14' ' ' LEU . 14.8 mtm180 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 75.209999999999994 110.854 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 1.032 HD21 HD11 ' A' ' 23' ' ' LEU . 31.5 tp . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.746 0.308 . . . . 74.439999999999998 110.925 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -98.65 159.9 14.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 71.230000000000004 110.853 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -139.31 171.9 13.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.475 . . . . 63.130000000000003 110.861 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.607 HD21 ' HG2' ' A' ' 82' ' ' ARG . 11.4 mt -148.16 128.14 13.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.126 -0.488 . . . . 74.209999999999994 110.967 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.1 mtp-105 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 74.319999999999993 110.875 179.962 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.0 ttm180 . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.86 0.362 . . . . 72.420000000000002 110.899 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.491 ' N ' ' O ' ' A' ' 14' ' ' LEU . 3.0 m-85 -143.76 158.52 43.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 75.340000000000003 110.842 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 1.032 HD11 HD21 ' A' ' 11' ' ' LEU . 12.8 tp -126.46 115.85 20.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 75.109999999999999 110.903 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.582 HG22 HD12 ' A' ' 14' ' ' LEU . 59.4 t -89.56 122.79 41.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 73.329999999999998 111.111 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.902 ' CG ' HD13 ' A' ' 63' ' ' ILE . 33.7 t60 -161.3 134.04 6.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 64.239999999999995 110.907 179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.498 ' HG2' ' CE1' ' A' ' 25' ' ' HIS . 40.4 mm-40 60.19 29.7 19.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 72.239999999999995 110.905 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.7 m 65.74 27.71 11.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 74.420000000000002 110.845 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.535 ' CE2' ' CD2' ' A' ' 69' ' ' HIS . 16.6 m-85 -126.07 -174.26 3.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 72.140000000000001 110.963 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.445 HD21 HD12 ' A' ' 14' ' ' LEU . 40.7 mt -135.31 130.9 35.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.219999999999999 110.898 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.468 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 2.0 m-85 -127.42 159.42 34.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.137 -0.483 . . . . 72.540000000000006 110.922 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.474 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 3.7 mtt-85 -116.33 148.8 40.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.103 -0.499 . . . . 74.140000000000001 110.873 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 41.3 tttp -71.13 109.12 4.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 71.420000000000002 110.916 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.475 ' C ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -83.78 -59.6 2.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.432 . . . . 62.409999999999997 110.898 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -153.85 -176.37 5.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 75.329999999999998 110.884 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -137.9 119.75 15.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 54.329999999999998 111.109 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.434 ' O ' ' N ' ' A' ' 38' ' ' GLU . . . -102.41 -174.73 2.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.31 -0.404 . . . . 53.439999999999998 111.157 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -45.35 93.16 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.722 -0.752 . . . . 72.409999999999997 112.506 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 36' ' ' ALA . 22.0 mt-10 58.68 40.53 23.22 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.905 0.383 . . . . 64.0 110.926 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.5 mtmm -150.93 157.93 43.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 63.299999999999997 110.845 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.5 t -135.13 117.45 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.172 -0.467 . . . . 71.439999999999998 111.175 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -82.3 135.02 35.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 75.109999999999999 110.935 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.589 ' CD1' HG23 ' A' ' 58' ' ' THR . 75.2 m95 -123.97 161.89 24.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.125 -0.489 . . . . 74.420000000000002 110.962 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -146.12 127.18 14.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.28 -0.418 . . . . 74.010000000000005 110.897 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.5 t -41.67 112.43 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.298 -0.41 . . . . 14.15 110.88 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.474 ' HB2' ' CZ ' ' A' ' 31' ' ' ARG . 19.8 ptt180 -42.28 -46.85 4.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 44.520000000000003 110.894 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.498 ' HB2' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -80.07 56.7 2.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.182 -0.463 . . . . 75.200000000000003 110.82 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.417 ' OE1' ' CA ' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -88.99 -38.75 14.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 75.219999999999999 110.88 -179.906 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.417 ' CA ' ' OE1' ' A' ' 47' ' ' GLN . . . -89.12 -68.97 0.74 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 70.439999999999998 111.099 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -41.64 -61.87 1.0 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.319999999999993 110.801 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.498 HD12 ' HB2' ' A' ' 46' ' ' ASP . 23.4 mt -77.75 -18.93 55.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 65.530000000000001 110.898 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.96 37.85 28.28 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.75 -0.738 . . . . 64.239999999999995 112.452 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.4 t -90.68 143.87 26.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.839 0.352 . . . . 63.009999999999998 110.887 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.8 mmt85 -125.54 31.49 5.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 63.420000000000002 110.906 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.7 t -88.7 137.58 32.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 64.430000000000007 110.897 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -125.63 141.87 51.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 75.329999999999998 110.938 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.46 152.11 51.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 62.240000000000002 111.095 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.584 HG22 ' N ' ' A' ' 58' ' ' THR . 91.8 mt -117.64 162.24 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 70.299999999999997 111.141 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.589 HG23 ' CD1' ' A' ' 42' ' ' TRP . 43.2 p -141.0 136.89 32.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 74.200000000000003 111.211 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.56 109.43 4.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 75.549999999999997 110.874 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 79.16 -101.03 1.81 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.763 -0.732 . . . . 54.43 112.45 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -128.96 9.17 5.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.735 0.302 . . . . 74.25 110.841 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -112.71 -179.82 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 75.510000000000005 110.826 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.902 HD13 ' CG ' ' A' ' 25' ' ' HIS . 14.4 tt -146.64 159.83 10.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 75.409999999999997 111.142 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.409 ' N ' HG12 ' A' ' 63' ' ' ILE . 36.5 mtm -139.73 152.28 46.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 73.519999999999996 110.843 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 50.3 t -119.62 139.58 46.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.219 -0.446 . . . . 72.540000000000006 111.135 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mmm -97.97 -51.79 3.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 74.319999999999993 110.868 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -128.13 172.74 10.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 63.020000000000003 110.902 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 51.0 p -87.68 -179.04 6.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 72.209999999999994 110.861 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.535 ' CD2' ' CE2' ' A' ' 28' ' ' PHE . 86.4 m-70 -111.05 136.56 49.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 65.120000000000005 110.902 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.5 p -79.45 -4.17 49.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 71.0 110.862 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.449 ' NE2' ' OD1' ' A' ' 46' ' ' ASP . 12.0 p80 -121.97 178.98 4.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 110.839 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -109.36 150.21 40.8 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.654 0.74 . . . . 45.299999999999997 110.873 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.76 155.29 66.32 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.668 2.246 . . . . 34.310000000000002 112.356 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -136.8 100.04 4.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.258 -0.428 . . . . 64.319999999999993 110.881 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mt -63.94 -21.42 66.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 73.340000000000003 110.875 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -76.51 -61.98 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 75.400000000000006 111.138 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.17 -33.49 64.92 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.763 -0.732 . . . . 74.409999999999997 112.512 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 tp -72.79 -48.1 40.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.775 0.321 . . . . 73.129999999999995 110.948 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -59.73 -29.1 67.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.451 . . . . 74.420000000000002 110.832 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.33 96.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 25.34 111.132 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 mt -75.96 -26.37 56.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.283 -0.417 . . . . 73.25 110.972 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.607 ' HG2' HD21 ' A' ' 14' ' ' LEU . 72.7 mtp85 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 71.109999999999999 110.905 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.682 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 33.8 tp . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.824 0.345 . . . . 73.120000000000005 110.91 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -105.33 151.9 23.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.183 -0.462 . . . . 72.530000000000001 110.891 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.682 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 66.4 m-85 -139.79 172.89 12.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 72.209999999999994 110.891 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.704 HD12 ' CG2' ' A' ' 24' ' ' VAL . 5.2 mt -147.27 156.5 42.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 65.299999999999997 110.881 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.0 tpp85 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 74.409999999999997 110.806 179.971 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.791 0.329 . . . . 73.530000000000001 110.864 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.421 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -99.61 167.78 10.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 73.340000000000003 110.893 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.493 HD11 HD21 ' A' ' 11' ' ' LEU . 7.0 tp -134.38 132.66 39.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 70.549999999999997 110.905 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.704 ' CG2' HD12 ' A' ' 14' ' ' LEU . 55.8 t -98.44 113.35 32.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 74.340000000000003 111.128 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.701 ' CG ' HD13 ' A' ' 63' ' ' ILE . 6.2 t60 -149.43 122.67 8.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 74.319999999999993 110.838 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 63.46 47.74 3.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.156 -0.474 . . . . 75.140000000000001 110.938 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.96 25.54 3.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 50.020000000000003 110.871 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -123.28 -179.17 4.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.082 -0.508 . . . . 72.450000000000003 110.903 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.507 HD21 ' CD1' ' A' ' 14' ' ' LEU . 22.6 mt -131.34 139.09 49.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.186 -0.461 . . . . 73.5 110.949 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.508 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -133.16 159.64 39.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.465 . . . . 71.319999999999993 110.924 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.421 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -123.47 124.57 43.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 62.340000000000003 110.912 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -46.37 112.94 0.55 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 63.310000000000002 110.838 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -90.35 -53.38 4.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 72.030000000000001 110.885 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.3 ptmm? -161.25 -176.61 5.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -143.67 133.3 23.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.27 -0.423 . . . . 43.119999999999997 111.075 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -109.82 69.14 0.69 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 64.109999999999999 111.079 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.77 -101.08 2.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.72 -0.752 . . . . 43.240000000000002 112.533 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -101.54 1.18 37.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.87 0.367 . . . . 70.540000000000006 110.924 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.409 ' CE ' HG21 ' A' ' 57' ' ' ILE . 48.2 mtpt -112.58 143.69 43.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.117 -0.492 . . . . 62.340000000000003 110.876 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.89 119.6 60.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 62.530000000000001 111.069 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.426 ' N ' ' CD1' ' A' ' 41' ' ' TYR . 6.5 m-30 -78.52 144.59 35.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.201 -0.454 . . . . 72.430000000000007 110.971 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.487 ' CD1' HG23 ' A' ' 58' ' ' THR . 79.7 m95 -136.08 123.09 21.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 64.109999999999999 110.939 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.8 ptt? -106.84 139.75 40.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 53.149999999999999 110.894 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.0 t -54.03 115.54 2.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 72.329999999999998 110.907 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 21.7 ptt-85 -41.59 -34.54 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 75.310000000000002 110.834 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -82.82 45.49 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 72.099999999999994 110.852 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.549 ' OE1' ' HB2' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -87.28 -27.97 22.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 73.430000000000007 110.937 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.549 ' HB2' ' OE1' ' A' ' 47' ' ' GLN . . . -97.85 -25.45 15.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 54.009999999999998 111.094 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 23.7 ttm-85 -90.8 -59.97 2.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 74.310000000000002 110.87 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.442 ' O ' ' N ' ' A' ' 52' ' ' CYS . 37.8 mt -96.53 22.7 7.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.2 -0.454 . . . . 72.510000000000005 110.888 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 37.76 29.63 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.822 -0.704 . . . . 75.340000000000003 112.536 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.442 ' N ' ' O ' ' A' ' 50' ' ' LEU . 4.7 t -80.92 99.32 8.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.827 0.346 . . . . 72.010000000000005 110.871 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 30.3 mmm-85 -80.6 7.38 10.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 74.25 110.869 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.9 t -54.82 110.92 0.72 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 54.420000000000002 110.83 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -112.36 166.97 10.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 64.409999999999997 110.916 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.692 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -148.36 166.67 27.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 53.509999999999998 111.11 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.409 HG21 ' CE ' ' A' ' 39' ' ' LYS . 86.8 mt -132.47 123.58 50.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 65.239999999999995 111.063 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.487 HG23 ' CD1' ' A' ' 42' ' ' TRP . 49.1 p -102.91 153.5 20.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.48 . . . . 64.530000000000001 111.161 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -153.12 109.82 3.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 51.229999999999997 110.857 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 71.46 -96.73 0.65 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.703 -0.761 . . . . 63.130000000000003 112.505 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.07 9.17 6.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.328 . . . . 71.120000000000005 110.857 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.434 ' NH1' ' HB3' ' A' ' 62' ' ' ARG . 14.8 mtp-105 -110.99 -176.92 3.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 64.140000000000001 110.858 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.701 HD13 ' CG ' ' A' ' 25' ' ' HIS . 19.4 tt -148.03 160.58 7.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.454 . . . . 63.439999999999998 111.072 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.692 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 8.1 ttp -142.53 148.44 37.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 74.420000000000002 110.847 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 93.4 t -118.57 141.97 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 72.120000000000005 111.091 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 9.4 mmm -105.59 -61.93 1.43 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 60.210000000000001 110.886 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.418 ' HD3' ' N ' ' A' ' 68' ' ' SER . 1.9 tmt_? -114.03 148.61 36.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 64.329999999999998 110.875 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.418 ' N ' ' HD3' ' A' ' 67' ' ' ARG . 13.7 p -68.73 -175.5 0.7 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 62.030000000000001 110.906 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.4 ' CE1' ' HH ' ' A' ' 30' ' ' TYR . 91.8 m-70 -112.07 142.86 43.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 74.200000000000003 110.812 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.3 t -92.39 9.16 35.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 73.099999999999994 110.807 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 28.5 p80 -138.97 161.3 37.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 71.019999999999996 110.835 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -94.23 155.43 39.93 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.609 0.718 . . . . 64.409999999999997 110.945 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.82 155.55 65.43 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.709 2.273 . . . . 64.140000000000001 112.32 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -134.46 80.25 1.84 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.83 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.596 HD23 ' N ' ' A' ' 75' ' ' LEU . 0.7 OUTLIER -46.57 -24.16 0.49 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 75.019999999999996 110.947 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.53 -50.97 32.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.143 -0.481 . . . . 74.310000000000002 111.131 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.32 -37.88 80.62 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.679 -0.772 . . . . 63.530000000000001 112.473 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.434 HD21 HH11 ' A' ' 82' ' ' ARG . 6.0 tp -69.7 -41.8 74.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.779 0.323 . . . . 63.109999999999999 110.918 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -60.96 -23.3 65.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.137 -0.483 . . . . 70.340000000000003 110.845 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.75 -60.56 2.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 53.210000000000001 111.065 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.2 mt -52.86 -45.92 67.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 71.439999999999998 110.948 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.504 ' HG2' HD21 ' A' ' 14' ' ' LEU . 36.4 mtp180 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.46 . . . . 71.239999999999995 110.907 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.853 HD21 HD11 ' A' ' 23' ' ' LEU . 15.4 tp . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.792 0.33 . . . . 75.310000000000002 110.923 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -105.41 141.52 36.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 72.219999999999999 110.87 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.647 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 19.7 m-85 -139.36 170.18 16.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 75.420000000000002 110.921 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 mt -143.72 146.59 33.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.155 -0.475 . . . . 72.030000000000001 110.888 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 62.0 mtp85 . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 74.400000000000006 110.909 179.961 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.812 0.339 . . . . 75.219999999999999 110.909 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -129.69 158.81 38.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 71.099999999999994 110.873 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.853 HD11 HD21 ' A' ' 11' ' ' LEU . 11.2 tp -122.22 115.34 22.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.194 -0.457 . . . . 65.319999999999993 110.908 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.5 t -89.95 116.33 31.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 72.209999999999994 111.158 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.806 ' CG ' HD13 ' A' ' 63' ' ' ILE . 14.3 t60 -153.97 129.25 9.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 71.530000000000001 110.889 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 62.66 37.76 12.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 74.409999999999997 110.904 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m 60.19 26.1 15.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 51.140000000000001 110.901 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.468 ' CE1' ' CE1' ' A' ' 71' ' ' HIS . 13.4 m-85 -126.82 -176.82 3.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 74.25 110.859 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.43 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 14.7 mt -134.33 134.25 41.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 63.409999999999997 110.915 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.508 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.1 m-85 -129.16 169.16 15.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.249 -0.432 . . . . 74.540000000000006 110.99 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -129.32 138.01 51.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 74.409999999999997 110.869 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.478 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 38.3 tttt -61.88 113.33 2.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 72.219999999999999 110.911 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -88.62 -47.56 8.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 74.430000000000007 110.909 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -157.28 169.27 25.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 74.140000000000001 110.906 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.72 123.14 23.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 73.0 111.152 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.3 34.73 1.39 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.449 . . . . 71.349999999999994 111.12 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.64 -88.7 0.94 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.708 -0.758 . . . . 64.239999999999995 112.537 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -92.29 -0.22 57.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.891 0.377 . . . . 63.329999999999998 110.883 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -121.6 157.78 30.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 72.120000000000005 110.837 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.456 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 2.5 t -138.46 112.9 8.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.236 -0.438 . . . . 70.530000000000001 111.123 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -77.11 139.3 39.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.114 -0.493 . . . . 71.109999999999999 110.978 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.585 ' CG ' HD22 ' A' ' 23' ' ' LEU . 81.6 m95 -128.48 165.98 19.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.148 -0.478 . . . . 63.350000000000001 110.889 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -151.84 140.68 20.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 73.530000000000001 110.919 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.0 t -51.06 106.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 71.030000000000001 110.872 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.43 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.3 ptt-85 -40.17 -33.63 0.25 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 63.340000000000003 110.844 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.97 52.35 0.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 65.519999999999996 110.874 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -73.12 -50.83 20.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.232 -0.44 . . . . 71.519999999999996 110.886 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.19 -10.01 26.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 74.209999999999994 111.028 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.3 ttt180 -84.03 -60.34 2.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 74.519999999999996 110.847 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 52' ' ' CYS . 94.3 mt -106.78 25.62 11.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.187 -0.461 . . . . 74.5 110.956 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.73 23.25 0.18 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.754 -0.736 . . . . 35.520000000000003 112.528 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 50' ' ' LEU . 6.1 t -77.46 141.44 39.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.791 0.329 . . . . 72.019999999999996 110.861 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.13 22.32 9.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 71.450000000000003 110.861 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.521 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 47.8 t -66.42 135.45 54.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 53.030000000000001 110.843 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 -128.72 160.5 32.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.086 -0.506 . . . . 71.230000000000004 110.839 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.445 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -154.86 150.3 27.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 25.41 111.067 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.463 HD12 ' CE ' ' A' ' 66' ' ' MET . 51.5 mt -120.38 131.61 72.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.446 . . . . 74.340000000000003 111.152 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.423 HG23 ' CD1' ' A' ' 42' ' ' TRP . 36.6 p -108.88 144.5 36.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 74.040000000000006 111.134 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -134.06 87.09 2.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.241 -0.436 . . . . 73.349999999999994 110.947 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.45 -87.07 1.55 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.753 -0.737 . . . . 73.409999999999997 112.413 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -126.25 -10.76 6.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.755 0.312 . . . . 70.340000000000003 110.871 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 51.8 mtm180 -92.4 -179.96 5.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.452 . . . . 74.420000000000002 110.951 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.806 HD13 ' CG ' ' A' ' 25' ' ' HIS . 19.8 tt -150.92 158.91 4.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 73.209999999999994 111.151 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.445 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 2.4 ttp -144.14 142.01 30.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 62.229999999999997 110.882 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 23.0 t -102.53 140.75 20.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 71.040000000000006 111.132 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.463 ' CE ' HD12 ' A' ' 57' ' ' ILE . 26.3 mmm -113.35 -64.12 1.35 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.506 . . . . 73.439999999999998 110.917 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -101.58 137.29 40.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 71.099999999999994 110.912 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 85.2 p -69.29 177.83 2.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 61.420000000000002 110.86 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.521 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 47.4 m-70 -111.52 145.74 38.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.102 -0.499 . . . . 72.319999999999993 110.886 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 8.6 t -97.44 13.78 28.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 70.120000000000005 110.955 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' HIS . . . . . 0.468 ' CE1' ' CE1' ' A' ' 28' ' ' PHE . 28.3 p80 -140.67 178.87 7.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.497 . . . . 62.420000000000002 110.833 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -111.46 152.2 43.78 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.589 0.709 . . . . 72.200000000000003 110.878 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.412 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.77 157.31 60.8 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.654 2.236 . . . . 63.219999999999999 112.328 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -135.93 83.64 2.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 75.349999999999994 110.841 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 12.6 mt -47.42 -29.54 2.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.227 -0.442 . . . . 71.230000000000004 110.901 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.96 -51.15 50.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.49 . . . . 52.119999999999997 111.162 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.65 -41.77 98.94 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.747 -0.739 . . . . 41.25 112.457 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tp -68.56 -51.51 41.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.793 0.33 . . . . 42.109999999999999 110.924 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -50.61 -22.59 2.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.439999999999998 110.858 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.414 ' O ' ' C ' ' A' ' 81' ' ' LEU . . . -69.55 -67.81 0.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 74.420000000000002 111.06 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.414 ' C ' ' O ' ' A' ' 80' ' ' ALA . 6.6 mt -37.4 -52.31 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 65.019999999999996 110.904 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.453 . . . . 74.239999999999995 110.848 179.942 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.668 HD21 HD11 ' A' ' 23' ' ' LEU . 27.9 tp . . . . . 0 CA--C 1.526 0.044 0 CA-C-O 120.741 0.305 . . . . 64.150000000000006 110.909 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -88.06 134.4 33.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 74.120000000000005 110.915 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.654 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 64.2 m-85 -133.56 172.87 12.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.123 -0.49 . . . . 74.349999999999994 110.886 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.621 HD12 ' CG2' ' A' ' 24' ' ' VAL . 10.9 mt -146.82 150.26 34.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.158 -0.474 . . . . 54.509999999999998 110.891 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.466 . . . . 73.230000000000004 110.838 -179.996 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 tpp85 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.898 0.38 . . . . 73.129999999999995 110.83 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -117.01 158.19 24.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 74.439999999999998 110.943 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.668 HD11 HD21 ' A' ' 11' ' ' LEU . 13.7 tp -124.88 115.99 21.51 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 75.129999999999995 110.939 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.621 ' CG2' HD12 ' A' ' 14' ' ' LEU . 41.4 t -90.62 113.53 26.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 71.120000000000005 111.107 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.627 ' CG ' HD13 ' A' ' 63' ' ' ILE . 15.3 t60 -148.43 124.51 10.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 71.430000000000007 110.868 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 62.73 44.37 6.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 74.099999999999994 110.87 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.6 m 55.79 25.27 8.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 62.530000000000001 110.793 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -125.99 172.93 9.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 70.439999999999998 110.86 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.474 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 33.5 mt -125.94 134.45 51.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 62.310000000000002 110.92 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.49 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.6 m-85 -127.75 167.3 16.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 74.400000000000006 110.912 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -132.6 133.37 43.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 74.230000000000004 110.903 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.533 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 73.5 tttt -55.81 114.92 2.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.246 -0.434 . . . . 72.310000000000002 110.935 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -88.88 -57.22 2.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 73.329999999999998 110.842 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.529 ' HD2' ' CG ' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -151.45 -177.69 6.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 64.349999999999994 110.85 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -132.92 138.92 47.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.461 . . . . 74.450000000000003 111.124 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -110.72 35.98 3.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 61.310000000000002 111.107 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.1 -78.59 0.52 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.843 -0.694 . . . . 72.120000000000005 112.466 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -105.02 -20.4 13.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.91 0.386 . . . . 74.150000000000006 110.875 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -98.98 163.94 12.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.197 -0.456 . . . . 64.329999999999998 110.902 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.0 t -134.32 120.68 34.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 61.420000000000002 111.104 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.529 ' CG ' ' HD2' ' A' ' 34' ' ' LYS . 2.9 m-85 -79.34 142.26 36.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 75.5 110.878 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.533 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 80.6 m95 -134.93 150.69 50.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 72.099999999999994 110.905 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -133.06 138.03 46.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 53.240000000000002 110.876 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.403 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.9 t -51.3 104.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 61.329999999999998 110.895 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.474 ' CZ ' HD13 ' A' ' 29' ' ' LEU . 15.9 ptt180 -40.47 -28.4 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.829 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 44' ' ' CYS . 2.9 m-20 -87.86 48.49 1.65 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.248 -0.433 . . . . 71.439999999999998 110.882 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -83.3 -40.45 19.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.198 -0.456 . . . . 75.319999999999993 110.892 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.37 -9.55 38.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 65.030000000000001 111.071 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -97.33 -55.26 2.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 73.510000000000005 110.838 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.436 ' O ' ' C ' ' A' ' 51' ' ' GLY . 28.4 mt -106.69 26.9 9.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 75.200000000000003 110.938 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLY . . . . . 0.436 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.62 56.13 0.78 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.677 -0.773 . . . . 61.399999999999999 112.529 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.6 t -126.47 118.34 24.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.835 0.35 . . . . 54.119999999999997 110.893 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.9 mmt-85 -93.44 2.74 56.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.205 -0.452 . . . . 74.420000000000002 110.874 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.468 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 37.8 t -40.82 105.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 72.109999999999999 110.871 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -102.93 -179.74 4.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 74.099999999999994 110.878 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.812 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -162.62 167.04 23.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 74.319999999999993 111.15 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 57.8 mt -131.52 123.89 53.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.287 -0.415 . . . . 70.209999999999994 111.11 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.84 HG22 HG13 ' A' ' 63' ' ' ILE . 31.3 p -108.92 141.19 41.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 75.310000000000002 111.133 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -147.24 111.54 5.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 70.530000000000001 110.886 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.73 -102.42 2.35 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.823 -0.704 . . . . 63.240000000000002 112.507 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -129.0 10.35 5.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.786 0.327 . . . . 74.0 110.87 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -113.27 -174.99 2.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 74.219999999999999 110.893 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.84 HG13 HG22 ' A' ' 58' ' ' THR . 18.5 tt -150.02 152.8 11.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 72.349999999999994 111.117 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.812 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 21.4 mtm -134.52 148.77 50.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 62.329999999999998 110.878 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.3 t -117.23 138.21 48.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 63.409999999999997 111.093 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 11.2 mtp -107.96 -54.69 2.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.485 . . . . 65.450000000000003 110.923 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.74 160.52 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 63.229999999999997 110.898 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 p -95.75 167.04 11.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 72.329999999999998 110.844 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.468 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 38.0 m-70 -104.07 129.97 51.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 74.450000000000003 110.82 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.0 t -89.06 13.11 13.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.163 -0.471 . . . . 55.210000000000001 110.868 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 19.1 p80 -133.34 172.79 12.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 74.109999999999999 110.837 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -104.65 151.41 39.27 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.711 . . . . 75.340000000000003 110.926 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 151.6 69.06 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.666 2.244 . . . . 73.239999999999995 112.303 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -112.7 81.76 1.54 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.189 -0.46 . . . . 54.109999999999999 110.834 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.9 mt -51.33 -17.69 0.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 52.140000000000001 110.857 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.86 -55.1 3.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 31.52 111.12 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.99 -37.52 91.59 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.717 -0.754 . . . . 52.299999999999997 112.526 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 12.6 tp -68.87 -51.01 44.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.779 0.323 . . . . 65.209999999999994 110.946 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -53.34 -30.93 41.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 75.200000000000003 110.87 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.05 -28.54 66.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 41.32 111.09 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mt -79.2 -39.02 34.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 72.299999999999997 110.885 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.506 ' HG2' HD21 ' A' ' 14' ' ' LEU . 4.0 mtp-105 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 72.510000000000005 110.847 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.553 HD22 ' HB ' ' A' ' 63' ' ' ILE . 11.8 tp . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.823 0.344 . . . . 74.310000000000002 110.872 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 13' ' ' PHE . 8.1 tp10 -103.56 146.57 28.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 74.230000000000004 110.958 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.409 ' N ' ' HG3' ' A' ' 12' ' ' GLU . 25.7 m-85 -139.44 172.93 12.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 72.219999999999999 110.84 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.9 mt -142.06 157.68 44.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 73.040000000000006 110.905 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.426 ' N ' ' HD2' ' A' ' 15' ' ' ARG . 2.5 mpt_? . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 72.420000000000002 110.849 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.817 0.341 . . . . 71.120000000000005 110.892 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -112.55 159.75 18.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.29 -0.414 . . . . 74.129999999999995 110.927 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.406 HD11 HD21 ' A' ' 11' ' ' LEU . 6.7 tp -131.96 130.72 41.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 73.299999999999997 110.953 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.7 t -97.1 111.43 27.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 44.219999999999999 111.137 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.663 ' CD2' HD13 ' A' ' 63' ' ' ILE . 2.3 t60 -148.05 129.55 14.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.429 . . . . 75.299999999999997 110.855 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 59.88 38.59 21.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 73.140000000000001 110.892 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 m 61.22 18.29 9.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.484 . . . . 73.310000000000002 110.863 -179.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -116.71 179.53 3.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 65.030000000000001 110.85 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 27.9 mt -130.37 135.4 48.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 74.140000000000001 110.886 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' TYR . . . . . 0.499 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.2 m-85 -128.37 163.01 25.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.278 -0.419 . . . . 74.25 110.911 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.4 mtt180 -117.48 126.55 52.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 70.310000000000002 110.808 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.509 ' HB2' ' CZ3' ' A' ' 42' ' ' TRP . 54.2 tttt -54.55 110.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 71.450000000000003 110.882 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.429 ' C ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -81.38 -58.63 2.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 61.140000000000001 110.934 179.895 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.83 -177.57 5.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 75.150000000000006 110.884 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -141.03 109.31 5.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 64.129999999999995 111.13 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.61 90.31 7.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 71.329999999999998 111.083 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 58.35 -92.89 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.737 -0.744 . . . . 74.430000000000007 112.505 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.446 ' CD ' ' N ' ' A' ' 38' ' ' GLU . 9.1 mp0 -106.99 9.97 30.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 74.109999999999999 110.871 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.5 mtmt -116.48 155.76 28.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 63.340000000000003 110.96 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 15.4 t -134.51 122.6 40.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.313 -0.403 . . . . 55.329999999999998 111.139 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -87.18 141.8 28.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.465 . . . . 63.409999999999997 110.851 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' TRP . . . . . 0.509 ' CZ3' ' HB2' ' A' ' 32' ' ' LYS . 67.5 m95 -135.29 163.38 30.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.082 -0.508 . . . . 75.299999999999997 110.94 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 12.3 ptt? -150.17 140.36 22.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.3 -0.409 . . . . 73.549999999999997 110.919 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -52.85 107.58 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 73.120000000000005 110.889 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.1 ptt-85 -40.23 -31.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 75.219999999999999 110.947 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -81.96 43.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 75.409999999999997 110.888 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -85.33 -34.93 21.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.209 -0.45 . . . . 72.25 110.866 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -96.24 -14.97 22.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 63.420000000000002 111.035 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -97.04 -58.72 1.95 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.271 -0.422 . . . . 71.0 110.901 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.0 mt -99.49 21.9 11.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 75.209999999999994 110.926 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.56 37.82 1.97 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.764 -0.732 . . . . 73.310000000000002 112.43 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 30.9 t -93.87 110.42 22.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.82 0.343 . . . . 41.140000000000001 110.838 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.414 ' O ' ' CD ' ' A' ' 55' ' ' ARG . 0.9 OUTLIER -91.94 19.38 6.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 74.010000000000005 110.893 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.5 t -63.09 108.49 1.25 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 73.510000000000005 110.92 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.469 ' HB3' ' HE2' ' A' ' 66' ' ' MET . 1.1 mpt_? -107.06 156.4 18.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 71.340000000000003 110.888 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -138.8 167.68 21.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 111.117 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.778 ' HB ' ' HE3' ' A' ' 64' ' ' MET . 55.2 mt -141.57 123.42 13.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.192 -0.458 . . . . 65.230000000000004 111.104 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.824 HG22 HG13 ' A' ' 63' ' ' ILE . 18.4 p -109.33 149.94 28.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.113 -0.494 . . . . 71.439999999999998 111.149 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.47 89.06 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 72.409999999999997 110.867 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 86.61 -87.56 1.56 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.733 -0.746 . . . . 71.200000000000003 112.477 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -126.5 -8.19 6.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.817 0.341 . . . . 52.130000000000003 110.898 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -91.4 -177.4 4.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 65.140000000000001 110.855 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.824 HG13 HG22 ' A' ' 58' ' ' THR . 5.9 tt -150.49 153.8 9.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 73.219999999999999 111.122 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' MET . . . . . 0.778 ' HE3' ' HB ' ' A' ' 57' ' ' ILE . 3.6 tmm? -138.87 151.52 47.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 71.200000000000003 110.85 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.7 t -111.58 134.07 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 75.230000000000004 111.173 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.469 ' HE2' ' HB3' ' A' ' 55' ' ' ARG . 13.0 mtm -103.26 -36.03 8.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 60.210000000000001 110.871 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -140.05 160.18 40.51 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.245 -0.434 . . . . 75.150000000000006 110.899 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.2 m -86.11 -179.52 6.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.186 -0.461 . . . . 74.010000000000005 110.826 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' HIS . . . . . 0.437 ' CE1' ' HH ' ' A' ' 30' ' ' TYR . 70.6 m-70 -113.15 137.44 51.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 71.420000000000002 110.844 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.8 t -94.24 14.27 20.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 61.409999999999997 110.883 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -140.69 173.6 11.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 71.430000000000007 110.822 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -106.34 152.29 40.5 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.589 0.709 . . . . 60.43 110.832 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 167.02 25.71 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.719 2.279 . . . . 74.450000000000003 112.358 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -144.35 82.93 1.71 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.28 -0.418 . . . . 72.430000000000007 110.866 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.1 mt -47.03 -25.47 0.83 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 72.310000000000002 110.895 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.25 -42.52 83.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.049999999999997 111.102 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.61 -38.31 21.0 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.777 -0.725 . . . . 72.120000000000005 112.468 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tp -67.64 -41.45 83.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.75 0.309 . . . . 43.229999999999997 110.915 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -63.81 -25.56 68.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.192 -0.458 . . . . 75.200000000000003 110.906 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.39 -51.6 59.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 41.509999999999998 111.138 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.18 -30.78 71.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 74.299999999999997 110.869 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mtp-105 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.446 . . . . 62.240000000000002 110.92 179.939 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.39 0 N-CA-C 112.515 -0.234 . . . . 70.530000000000001 112.515 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.1 m -128.95 110.05 11.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.847 0.356 . . . . 75.219999999999999 110.882 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 m -134.14 131.17 38.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.129 -0.487 . . . . 74.230000000000004 110.855 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.38 164.87 29.36 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.724 -0.751 . . . . 72.349999999999994 112.533 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.1 t -124.49 112.59 17.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.901 0.382 . . . . 32.240000000000002 110.888 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 81.0 p -153.7 145.19 23.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 55.43 110.842 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -56.6 -61.42 7.5 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.756 -0.735 . . . . 71.140000000000001 112.435 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.466 HD12 ' HG2' ' A' ' 62' ' ' ARG . 14.7 tp -87.75 98.15 11.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.753 0.311 . . . . 72.340000000000003 110.857 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -86.76 145.96 40.12 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.635 0.731 . . . . 73.129999999999995 110.826 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.434 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 53.0 Cg_endo -69.85 -172.33 0.57 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.721 2.281 . . . . 70.420000000000002 112.33 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.485 HD21 HD11 ' A' ' 23' ' ' LEU . 16.4 tp -154.83 146.45 23.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 52.420000000000002 110.888 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -106.19 150.24 26.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 61.130000000000003 110.875 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -137.81 172.47 12.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 71.129999999999995 110.807 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.43 HD21 ' CG ' ' A' ' 82' ' ' ARG . 8.5 mt -142.11 157.53 44.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.065 -0.516 . . . . 63.43 110.883 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -127.97 124.52 37.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 64.209999999999994 110.875 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.472 HG23 ' O ' ' A' ' 20' ' ' GLY . 0.1 OUTLIER -120.07 165.52 14.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 74.030000000000001 111.126 -179.885 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.45 ' O ' ' C ' ' A' ' 18' ' ' LEU . 6.3 m -54.13 -174.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 74.439999999999998 110.851 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.45 ' C ' ' O ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -34.56 101.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.105 -0.498 . . . . 72.120000000000005 110.885 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.03 -22.34 0.11 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.722 -0.751 . . . . 52.509999999999998 112.482 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.472 ' O ' HG23 ' A' ' 16' ' ' THR . . . 115.72 -166.68 12.28 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.764 -0.731 . . . . 74.219999999999999 112.454 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.11 150.53 27.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.836 0.351 . . . . 63.240000000000002 110.904 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -99.49 167.88 10.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 73.129999999999995 110.927 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.485 HD11 HD21 ' A' ' 11' ' ' LEU . 10.0 tp -129.43 125.98 37.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 73.040000000000006 110.951 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.578 HG11 ' NH2' ' A' ' 82' ' ' ARG . 77.6 t -95.38 116.57 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 64.230000000000004 111.119 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.801 ' CG ' HD13 ' A' ' 63' ' ' ILE . 9.0 t60 -154.77 126.08 7.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 72.439999999999998 110.902 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 63.89 38.51 8.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 73.420000000000002 110.847 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.1 m 58.55 24.61 12.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 71.239999999999995 110.858 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -121.52 -177.3 3.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.115 -0.493 . . . . 74.019999999999996 110.887 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.574 HD12 ' HE ' ' A' ' 45' ' ' ARG . 69.8 mt -132.76 132.98 42.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.093 -0.503 . . . . 45.409999999999997 110.935 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.499 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -127.63 170.07 13.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.175 -0.466 . . . . 73.450000000000003 110.888 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.452 ' NE ' ' HB2' ' A' ' 45' ' ' ARG . 20.3 mtt180 -131.18 137.09 48.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 55.43 110.83 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.45 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 37.6 tttt -64.42 110.52 2.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 62.450000000000003 110.9 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -82.66 -59.25 2.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 63.420000000000002 110.888 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.484 ' HE2' ' CD2' ' A' ' 41' ' ' TYR . 10.1 pttm -142.81 177.87 8.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 74.239999999999995 110.852 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -142.79 120.8 12.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.245 -0.434 . . . . 62.140000000000001 111.098 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.85 32.68 0.8 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 70.230000000000004 111.1 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.07 -60.31 4.91 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.753 -0.737 . . . . 73.040000000000006 112.508 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -105.79 -13.04 15.66 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.864 0.364 . . . . 74.219999999999999 110.859 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.444 ' HG2' ' CG ' ' A' ' 59' ' ' GLN . 36.2 mtmt -121.24 148.36 44.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.158 -0.474 . . . . 74.329999999999998 110.877 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.414 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 3.5 t -125.76 111.12 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 72.400000000000006 111.152 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.484 ' CD2' ' HE2' ' A' ' 34' ' ' LYS . 3.6 m-85 -79.72 141.77 36.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 61.25 110.928 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.475 ' CD1' HG23 ' A' ' 58' ' ' THR . 63.6 m95 -130.29 166.28 20.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.033 -0.53 . . . . 75.409999999999997 110.938 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.0 ptt? -146.75 135.49 22.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 64.140000000000001 110.879 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.9 t -50.16 109.6 0.31 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 63.43 110.869 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.574 ' HE ' HD12 ' A' ' 29' ' ' LEU . 39.1 ptt85 -44.48 -23.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 74.430000000000007 110.923 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.485 ' HB3' HD12 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -85.47 30.86 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 61.329999999999998 110.856 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -82.01 -26.11 34.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 75.019999999999996 110.913 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.04 -23.56 16.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 71.310000000000002 111.17 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.0 tpp85 -96.7 -60.56 1.58 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.477 . . . . 64.209999999999994 110.86 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.535 HD13 ' CG ' ' A' ' 71' ' ' HIS . 34.8 mt -94.34 22.79 5.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 71.420000000000002 110.889 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 38.08 41.88 1.08 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.742 -0.742 . . . . 63.210000000000001 112.486 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.2 t -90.26 120.76 31.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.907 0.384 . . . . 70.099999999999994 110.814 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -99.3 13.33 33.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 63.329999999999998 110.862 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.7 t -65.03 117.74 8.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 64.239999999999995 110.874 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -114.87 159.4 20.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 75.219999999999999 110.917 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.697 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -144.74 164.45 30.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 71.319999999999993 111.097 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 64' ' ' MET . 69.1 mt -127.25 129.23 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.319999999999993 111.124 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.475 HG23 ' CD1' ' A' ' 42' ' ' TRP . 42.2 p -110.36 136.84 48.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 63.100000000000001 111.156 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.444 ' CG ' ' HG2' ' A' ' 39' ' ' LYS . 4.7 mt-30 -144.48 116.23 8.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 74.120000000000005 110.945 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 70.19 -99.2 0.69 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.71 -0.757 . . . . 64.200000000000003 112.535 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.456 ' HB3' HD11 ' A' ' 8' ' ' LEU . 4.5 t-160 -128.26 4.84 5.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.763 0.316 . . . . 75.010000000000005 110.803 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.466 ' HG2' HD12 ' A' ' 8' ' ' LEU . 42.5 mtm180 -107.01 -175.22 2.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.209999999999994 110.817 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.801 HD13 ' CG ' ' A' ' 25' ' ' HIS . 21.3 tt -150.81 162.75 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 70.200000000000003 111.074 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.697 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 3.9 mpp? -141.6 147.66 37.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.108 -0.496 . . . . 62.219999999999999 110.864 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.7 t -116.76 130.13 72.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 71.040000000000006 111.121 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 19.4 mtp -89.42 -64.08 1.19 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.211 -0.449 . . . . 72.319999999999993 110.852 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.9 ttm180 -112.34 175.93 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.268 -0.424 . . . . 74.129999999999995 110.901 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.4 p -90.99 -176.18 4.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 75.319999999999993 110.909 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -114.17 137.71 51.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 74.040000000000006 110.889 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.3 t -93.27 13.88 19.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.234 -0.439 . . . . 71.420000000000002 110.839 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.535 ' CG ' HD13 ' A' ' 50' ' ' LEU . 26.7 p80 -141.48 169.29 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 74.310000000000002 110.866 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.441 ' N ' ' CD ' ' A' ' 72' ' ' GLN . 1.8 mp0 -102.57 151.79 38.29 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.576 0.703 . . . . 55.539999999999999 110.92 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.88 149.6 66.32 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.639 2.226 . . . . 63.329999999999998 112.347 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -124.76 81.14 1.92 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 75.540000000000006 110.816 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.403 ' N ' HD23 ' A' ' 75' ' ' LEU . 6.5 mt -48.75 -22.9 0.88 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 62.350000000000001 110.919 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -75.24 -41.33 57.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.400000000000006 111.103 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -80.68 -31.38 36.59 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.724 -0.75 . . . . 71.420000000000002 112.486 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.6 tp -68.72 -38.31 80.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.707 0.289 . . . . 72.310000000000002 110.891 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -70.3 -34.72 73.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.187 -0.46 . . . . 75.329999999999998 110.896 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.93 -20.09 66.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 73.420000000000002 111.062 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.518 HD13 ' CD1' ' A' ' 29' ' ' LEU . 3.0 mt -90.15 -21.92 21.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 73.540000000000006 110.888 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.578 ' NH2' HG11 ' A' ' 24' ' ' VAL . 28.9 mtt180 -82.96 -28.66 29.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 74.340000000000003 110.877 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.732 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.9 OUTLIER -60.7 -43.28 97.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 74.150000000000006 110.952 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.423 ' N ' ' CG ' ' A' ' 83' ' ' GLN . 1.7 ptm180 -71.64 -5.61 34.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.118 -0.492 . . . . 73.549999999999997 110.823 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -100.79 -40.35 7.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 72.230000000000004 110.872 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.411 ' C ' HD12 ' A' ' 87' ' ' LEU . 23.1 mtp180 -82.8 14.78 3.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.173 -0.467 . . . . 70.319999999999993 110.852 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.732 HD13 ' O ' ' A' ' 83' ' ' GLN . 6.8 mp . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 63.32 110.894 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.448 -0.261 . . . . 45.100000000000001 112.448 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.2 p -49.12 144.85 4.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.856 0.36 . . . . 71.230000000000004 110.872 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.8 t -133.97 82.71 1.99 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 60.109999999999999 110.848 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -161.35 42.04 0.4 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.803 -0.713 . . . . 74.400000000000006 112.526 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.8 p -89.75 122.05 32.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.857 0.361 . . . . 63.140000000000001 110.882 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.8 m -121.93 138.67 54.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 45.219999999999999 110.858 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.83 -4.07 7.46 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.726 -0.749 . . . . 70.519999999999996 112.5 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.453 ' HB2' ' CG ' ' A' ' 62' ' ' ARG . 1.3 pt? -175.11 141.4 0.57 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.768 0.318 . . . . 71.25 110.894 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.449 ' HD3' ' N ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -75.1 144.14 78.53 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.681 0.753 . . . . 62.329999999999998 110.855 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.513 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 53.9 Cg_endo -69.73 -165.2 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.69 2.26 . . . . 73.049999999999997 112.367 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.74 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 14.5 tp -151.88 145.23 24.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.207 -0.452 . . . . 74.239999999999995 110.931 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.449 ' C ' ' CD1' ' A' ' 13' ' ' PHE . 34.0 tt0 -113.52 145.73 40.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 72.510000000000005 110.911 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.74 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 0.8 OUTLIER -140.0 167.9 21.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 75.400000000000006 110.898 -179.925 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.859 HD21 ' HG2' ' A' ' 82' ' ' ARG . 8.9 mt -137.57 117.53 13.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 63.420000000000002 111.012 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -73.11 135.71 44.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 72.209999999999994 110.903 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 p -115.99 150.82 36.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 72.200000000000003 111.152 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 p -80.58 123.76 28.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 63.409999999999997 110.877 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.9 mt 41.25 28.17 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 73.450000000000003 110.97 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.49 -25.4 2.19 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.771 -0.728 . . . . 63.329999999999998 112.488 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 120.71 -143.2 16.24 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.679 -0.772 . . . . 51.310000000000002 112.493 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -129.04 144.79 51.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.811 0.339 . . . . 63.329999999999998 110.833 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -110.95 164.27 12.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 63.109999999999999 110.909 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.635 HD11 HD21 ' A' ' 11' ' ' LEU . 5.4 tp -129.16 113.68 15.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 74.540000000000006 110.962 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -88.01 112.08 23.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 74.030000000000001 111.11 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.808 ' CG ' HD13 ' A' ' 63' ' ' ILE . 9.2 t60 -149.27 125.49 10.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.151 -0.477 . . . . 72.439999999999998 110.821 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 63.21 42.96 6.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.24 -0.436 . . . . 75.109999999999999 110.904 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.7 m 56.05 19.94 4.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 45.149999999999999 110.902 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -116.83 -175.42 2.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.016 -0.538 . . . . 63.119999999999997 110.915 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.5 mt -136.61 133.6 36.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.161 -0.472 . . . . 71.340000000000003 110.922 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.515 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -129.23 163.06 26.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 73.430000000000007 110.914 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.8 mtp180 -124.77 139.88 53.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 71.200000000000003 110.928 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.8 tttt -60.91 116.18 4.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 72.120000000000005 110.898 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -91.97 -57.57 2.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 75.209999999999994 110.904 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.7 pttt -151.32 168.48 24.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 63.140000000000001 110.924 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -132.7 119.19 20.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 63.100000000000001 111.09 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -82.54 38.01 0.54 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 74.340000000000003 111.067 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.21 -50.59 4.0 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.755 -0.736 . . . . 60.100000000000001 112.5 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -114.44 -27.81 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.908 0.385 . . . . 54.520000000000003 110.878 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.767 ' HE2' HD13 ' A' ' 57' ' ' ILE . 52.0 mtpt -104.61 154.81 19.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 73.200000000000003 110.883 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 t -127.87 111.97 26.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.275 -0.421 . . . . 74.230000000000004 111.102 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.521 ' CZ ' HD11 ' A' ' 57' ' ' ILE . 3.4 m-85 -79.45 145.27 33.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 62.130000000000003 110.893 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.619 ' CD1' HG23 ' A' ' 58' ' ' THR . 66.5 m95 -135.3 163.14 30.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.117 -0.492 . . . . 73.140000000000001 110.875 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.9 ptt? -145.79 132.06 19.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 71.019999999999996 110.909 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.406 ' C ' ' N ' ' A' ' 46' ' ' ASP . 1.8 t -46.1 108.46 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 72.439999999999998 110.813 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -43.49 -23.65 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 70.349999999999994 110.858 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.446 ' CB ' HD12 ' A' ' 50' ' ' LEU . 3.3 m-20 -81.39 42.06 0.65 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 64.510000000000005 110.822 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -85.8 -36.09 20.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 71.230000000000004 110.934 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.89 -14.57 20.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 63.310000000000002 111.128 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -98.91 -53.71 3.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 60.149999999999999 110.914 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.447 ' O ' ' C ' ' A' ' 51' ' ' GLY . 33.9 mt -108.01 27.34 9.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.201 -0.454 . . . . 72.439999999999998 110.903 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.447 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.63 47.08 0.61 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.761 -0.733 . . . . 70.409999999999997 112.484 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.3 t -97.59 142.71 29.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.759 0.314 . . . . 40.039999999999999 110.895 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.43 ' HD2' ' N ' ' A' ' 53' ' ' ARG . 0.4 OUTLIER -118.37 -0.87 11.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.172 -0.467 . . . . 74.140000000000001 110.926 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.556 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . 1.1 t -52.43 116.13 2.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.205 -0.452 . . . . 64.030000000000001 110.862 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.6 mtm105 -111.14 171.16 7.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 72.040000000000006 110.819 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.635 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -160.68 151.32 18.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 74.420000000000002 111.092 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.767 HD13 ' HE2' ' A' ' 39' ' ' LYS . 23.0 mt -115.49 130.16 70.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 74.219999999999999 111.099 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.619 HG23 ' CD1' ' A' ' 42' ' ' TRP . 28.3 p -111.32 141.47 44.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 50.210000000000001 111.156 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.415 ' NE2' ' HG2' ' A' ' 39' ' ' LYS . 10.7 mt-30 -146.72 109.3 4.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 75.25 110.9 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 75.29 -95.95 0.98 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.718 -0.753 . . . . 72.420000000000002 112.448 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.513 ' CD2' ' HA ' ' A' ' 10' ' ' PRO . 1.4 t60 -129.03 1.18 5.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.804 0.335 . . . . 73.420000000000002 110.818 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.453 ' CG ' ' HB2' ' A' ' 8' ' ' LEU . 19.7 mmm-85 -102.79 -176.41 3.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 74.129999999999995 110.894 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.808 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.4 161.97 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.199 -0.455 . . . . 63.439999999999998 111.158 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.635 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 16.8 ttm -138.62 141.28 39.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 61.219999999999999 110.933 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.2 t -106.41 133.25 51.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 53.030000000000001 111.129 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 23.5 mmt -93.87 -65.1 1.01 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 74.120000000000005 110.956 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -119.5 -178.27 3.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 63.530000000000001 110.903 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 77.3 p -91.82 -175.36 4.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 73.019999999999996 110.895 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.556 ' CE1' ' HB3' ' A' ' 54' ' ' SER . 75.8 m-70 -117.84 144.09 45.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 63.049999999999997 110.896 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 90.0 m -97.07 11.2 37.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 72.030000000000001 110.873 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 28.6 p80 -139.08 166.28 24.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 72.310000000000002 110.873 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -97.7 152.29 38.06 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.569 0.699 . . . . 74.049999999999997 110.953 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.71 160.31 50.2 Favored 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 122.755 2.303 . . . . 64.230000000000004 112.264 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.24 93.48 2.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.115 -0.493 . . . . 75.519999999999996 110.841 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.754 HD23 ' N ' ' A' ' 75' ' ' LEU . 0.5 OUTLIER -60.99 -22.18 64.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 74.239999999999995 110.93 -179.93 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.2 -55.38 9.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 63.130000000000003 111.124 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.22 -29.1 74.29 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.687 -0.768 . . . . 73.230000000000004 112.536 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 10.9 tp -77.33 -48.59 16.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.788 0.327 . . . . 60.020000000000003 110.896 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -64.19 -25.0 67.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 63.549999999999997 110.849 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.44 -25.73 63.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 74.409999999999997 111.121 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mt -79.12 -49.63 12.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.166 -0.47 . . . . 62.210000000000001 110.915 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.859 ' HG2' HD21 ' A' ' 14' ' ' LEU . 19.8 mtm180 -55.07 -53.62 53.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.481 . . . . 54.539999999999999 110.907 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -40.42 -40.3 1.17 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 72.319999999999993 110.913 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -62.81 -40.8 98.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 74.040000000000006 110.881 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.436 ' N ' ' O ' ' A' ' 82' ' ' ARG . 25.6 mm-40 -78.83 -56.88 4.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.185 -0.461 . . . . 70.540000000000006 110.869 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.422 ' O ' ' NE ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -133.78 163.74 28.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 72.209999999999994 110.816 -179.885 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.8 mt . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.48 . . . . 74.030000000000001 110.964 -179.965 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 N-CA-C 112.494 -0.242 . . . . 52.119999999999997 112.494 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.2 p -90.65 36.24 0.89 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.933 0.397 . . . . 53.229999999999997 110.88 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.8 p -112.75 132.7 55.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 72.430000000000007 110.916 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -165.63 -105.03 0.18 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.712 -0.756 . . . . 44.009999999999998 112.474 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.4 t 69.13 26.16 5.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.835 0.35 . . . . 53.25 110.819 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.4 t -85.4 80.0 9.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 71.120000000000005 110.919 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.03 -107.61 3.53 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.706 -0.759 . . . . 71.109999999999999 112.465 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.715 HD12 ' CG ' ' A' ' 62' ' ' ARG . 1.4 pt? -62.79 139.48 58.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.805 0.336 . . . . 75.150000000000006 110.916 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -70.03 144.01 92.31 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.6 0.715 . . . . 72.340000000000003 110.881 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.516 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 53.5 Cg_endo -69.8 -163.83 0.12 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.649 2.233 . . . . 70.129999999999995 112.383 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.743 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 15.8 tp -159.82 143.31 14.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.243 -0.435 . . . . 71.540000000000006 110.875 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -106.42 151.04 25.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 43.130000000000003 110.85 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.743 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 48.9 m-85 -139.98 170.52 15.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 74.420000000000002 110.866 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.5 mt -143.89 162.25 36.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 71.239999999999995 110.936 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.7 mtt85 -127.23 136.51 52.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 74.310000000000002 110.896 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.2 p -100.97 142.87 31.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 72.319999999999993 111.18 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -39.07 -49.65 1.78 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 63.340000000000003 110.93 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.1 mt -79.78 172.88 13.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.117 -0.492 . . . . 75.299999999999997 110.944 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.97 78.77 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.648 -0.787 . . . . 71.439999999999998 112.5 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -165.27 136.87 4.39 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.772 -0.727 . . . . 70.319999999999993 112.501 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -111.33 151.18 28.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 73.519999999999996 110.899 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -116.04 165.29 13.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 75.239999999999995 110.904 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.591 HD22 ' CG ' ' A' ' 42' ' ' TRP . 10.6 tp -131.71 117.59 18.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 73.239999999999995 110.86 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.685 HG11 ' NH2' ' A' ' 82' ' ' ARG . 97.5 t -93.55 111.7 25.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.453 . . . . 73.329999999999998 111.101 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.817 ' CG ' HD13 ' A' ' 63' ' ' ILE . 57.5 t60 -147.98 132.61 17.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 73.239999999999995 110.832 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.422 ' HG3' ' NE2' ' A' ' 25' ' ' HIS . 23.6 mt-10 59.6 35.58 22.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 73.209999999999994 110.892 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m 63.43 29.32 15.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 75.040000000000006 110.909 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 22.1 m-85 -130.72 -178.17 4.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 70.340000000000003 110.91 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.408 HD13 ' HE ' ' A' ' 45' ' ' ARG . 16.2 mt -133.38 133.15 42.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 72.5 110.913 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.495 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.2 m-85 -125.71 161.51 27.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 60.229999999999997 110.919 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.473 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 3.3 mtt-85 -115.63 126.35 54.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 72.400000000000006 110.822 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.505 ' HB2' ' CH2' ' A' ' 42' ' ' TRP . 15.6 ttpt -57.45 110.07 0.8 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.451 . . . . 73.409999999999997 110.86 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -82.38 -58.14 3.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 74.430000000000007 110.891 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.1 pttp -149.88 -176.66 5.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 45.329999999999998 110.88 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.58 117.17 7.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 65.519999999999996 111.173 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.34 80.23 4.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 51.119999999999997 111.098 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.68 -78.14 0.37 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.717 -0.754 . . . . 64.409999999999997 112.503 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -116.19 -13.8 11.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.963 0.411 . . . . 74.430000000000007 110.938 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.634 ' HE3' HG21 ' A' ' 57' ' ' ILE . 26.8 mtpp -94.08 149.64 21.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.114 -0.494 . . . . 75.430000000000007 110.937 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.408 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 1.7 t -132.55 118.99 37.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 72.349999999999994 111.126 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -87.49 134.22 33.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 74.450000000000003 110.898 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.591 ' CG ' HD22 ' A' ' 23' ' ' LEU . 68.5 m95 -124.32 168.17 13.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 73.400000000000006 110.893 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -152.86 133.54 13.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.246 -0.434 . . . . 75.540000000000006 110.866 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -42.89 111.02 0.22 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.43 . . . . 73.310000000000002 110.888 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 31' ' ' ARG . 37.0 ptt85 -52.36 -19.32 2.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 72.319999999999993 110.844 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.16 10.81 3.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.181 -0.463 . . . . 73.049999999999997 110.895 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' A' ' 52' ' ' CYS . 0.0 OUTLIER -68.75 -8.41 42.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 64.109999999999999 110.88 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.81 -43.95 7.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 71.549999999999997 111.067 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -93.38 -47.83 6.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 45.100000000000001 110.848 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.418 HD13 ' CG ' ' A' ' 71' ' ' HIS . 29.5 mt -88.93 -12.48 41.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 55.130000000000003 110.922 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 70.59 -0.51 26.51 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.789 -0.72 . . . . 71.430000000000007 112.484 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.403 ' O ' ' CB ' ' A' ' 47' ' ' GLN . 32.9 t -47.2 144.76 2.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.824 0.345 . . . . 60.340000000000003 110.884 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -125.07 19.29 8.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 72.319999999999993 110.895 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.418 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . 32.3 t -66.86 111.64 3.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 72.209999999999994 110.862 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -109.98 145.19 37.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 74.310000000000002 110.934 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.583 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -137.37 154.93 49.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.22 -0.445 . . . . 62.020000000000003 111.029 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.634 HG21 ' HE3' ' A' ' 39' ' ' LYS . 75.7 mt -111.33 135.12 51.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 74.5 111.103 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.6 p -117.84 128.76 55.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 61.549999999999997 111.18 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.405 ' CG ' ' HG2' ' A' ' 39' ' ' LYS . 9.8 mt-30 -131.81 95.1 3.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 71.200000000000003 110.85 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 87.4 -95.44 2.08 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.74 -0.743 . . . . 65.340000000000003 112.502 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.516 ' CD2' ' HA ' ' A' ' 10' ' ' PRO . 1.4 t60 -127.09 0.23 6.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.797 0.332 . . . . 72.310000000000002 110.882 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.715 ' CG ' HD12 ' A' ' 8' ' ' LEU . 15.3 mmm-85 -104.18 -179.26 3.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 63.240000000000002 110.814 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.817 HD13 ' CG ' ' A' ' 25' ' ' HIS . 17.6 tt -150.3 160.57 4.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 72.400000000000006 111.147 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.583 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 4.5 mpp? -137.65 140.99 41.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 71.450000000000003 110.896 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 92.6 t -102.7 127.9 56.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 71.430000000000007 111.113 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.7 mtm -105.16 -16.59 14.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 110.865 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -154.49 160.28 41.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 75.409999999999997 110.851 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 88.2 p -90.09 179.25 5.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 62.439999999999998 110.831 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.486 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 38.4 m-70 -116.5 134.28 55.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.089 -0.505 . . . . 64.540000000000006 110.881 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 45.4 t -85.85 4.94 34.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 44.310000000000002 110.854 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.418 ' CG ' HD13 ' A' ' 50' ' ' LEU . 28.2 p80 -131.6 163.97 26.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.454 . . . . 74.319999999999993 110.869 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -100.82 149.21 35.99 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.617 0.722 . . . . 73.109999999999999 110.898 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.49 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 54.3 Cg_endo -69.71 156.47 63.39 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.692 2.261 . . . . 62.149999999999999 112.395 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.93 95.69 3.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.233 -0.439 . . . . 71.400000000000006 110.885 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mt -57.06 -14.82 4.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 64.319999999999993 110.924 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -74.47 -46.26 40.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.249 -0.432 . . . . 63.100000000000001 111.148 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.67 -31.57 40.11 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.686 -0.768 . . . . 62.420000000000002 112.508 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -70.66 -42.49 70.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.786 0.327 . . . . 64.510000000000005 110.964 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -64.56 -35.76 82.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 71.519999999999996 110.934 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.37 -37.98 79.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 70.400000000000006 111.083 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.3 mt -69.94 -22.58 63.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.272 -0.422 . . . . 75.329999999999998 110.916 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.685 ' NH2' HG11 ' A' ' 24' ' ' VAL . 35.7 mtt180 -89.02 -25.26 22.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 72.150000000000006 110.891 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -77.02 -27.11 54.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 73.120000000000005 110.954 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -73.48 -25.76 60.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 75.530000000000001 110.838 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.52 -50.36 12.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.479 . . . . 70.129999999999995 110.936 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.85 175.88 8.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.129 -0.487 . . . . 72.019999999999996 110.896 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.445 HD23 ' C ' ' A' ' 87' ' ' LEU . 4.9 tt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 70.430000000000007 110.932 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.471 -0.252 . . . . 53.399999999999999 112.471 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.6 t -123.75 75.34 1.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.869 0.366 . . . . 73.400000000000006 110.875 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.2 m -99.04 -55.31 2.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 54.200000000000003 110.896 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 59.15 -103.57 0.41 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.707 -0.759 . . . . 73.120000000000005 112.525 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 43.3 t -87.01 138.97 31.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.85 0.357 . . . . 72.239999999999995 110.801 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.2 m -77.19 167.22 22.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 73.409999999999997 110.846 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 112.04 22.17 6.03 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.701 -0.761 . . . . 54.140000000000001 112.482 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.0 tp -77.96 99.52 6.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.801 0.334 . . . . 71.349999999999994 110.948 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -78.4 146.71 70.74 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.619 0.723 . . . . 74.120000000000005 110.868 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 -169.02 0.3 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.678 2.252 . . . . 62.009999999999998 112.312 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.976 HD21 HD11 ' A' ' 23' ' ' LEU . 11.1 tp -157.89 148.33 20.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.439999999999998 110.892 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.406 ' CD ' ' NH1' ' A' ' 82' ' ' ARG . 24.8 tt0 -104.51 144.45 31.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 74.319999999999993 110.916 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.405 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 20.4 m-85 -140.03 171.92 13.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 65.219999999999999 110.85 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.675 HD11 ' CD ' ' A' ' 82' ' ' ARG . 6.2 mt -144.21 155.82 44.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 73.140000000000001 110.973 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -116.8 141.38 48.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 72.400000000000006 110.822 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.0 p -112.6 173.17 6.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 72.329999999999998 111.149 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.8 p -108.76 -36.18 6.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.445 . . . . 65.319999999999993 110.851 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.7 mt -91.85 -47.61 7.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.12 -0.491 . . . . 71.310000000000002 110.908 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -82.85 -112.42 0.49 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.719 -0.753 . . . . 73.0 112.486 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.24 -103.89 0.3 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.746 -0.74 . . . . 41.310000000000002 112.497 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -121.81 156.75 32.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.91 0.386 . . . . 74.519999999999996 110.822 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -129.26 158.6 38.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 65.349999999999994 110.868 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.976 HD11 HD21 ' A' ' 11' ' ' LEU . 11.1 tp -123.18 116.12 22.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 73.340000000000003 110.897 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.53 116.19 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 75.120000000000005 111.152 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.809 ' CG ' HD13 ' A' ' 63' ' ' ILE . 10.5 t60 -152.29 126.73 9.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 63.310000000000002 110.874 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 62.29 42.79 8.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.26 -0.427 . . . . 63.340000000000003 110.914 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.7 m 55.22 27.73 10.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.487 . . . . 73.430000000000007 110.847 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -125.99 -176.49 3.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 73.439999999999998 110.893 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 19.4 mt -135.33 131.99 37.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 72.040000000000006 110.895 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.515 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -126.7 168.77 13.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.473 . . . . 75.219999999999999 110.968 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.451 ' HB3' ' CZ ' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -127.97 138.92 52.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 54.530000000000001 110.888 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.501 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 33.6 tttp -63.2 112.38 2.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 74.140000000000001 110.936 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -86.73 -58.39 2.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 72.439999999999998 110.921 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.5 pttm -146.88 -177.58 5.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.145 -0.48 . . . . 74.230000000000004 110.864 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -144.41 121.83 11.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 75.430000000000007 111.184 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.5 51.11 2.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 62.210000000000001 111.121 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.94 -59.8 3.05 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.799 -0.715 . . . . 64.219999999999999 112.501 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.413 ' CD ' ' N ' ' A' ' 38' ' ' GLU . 13.5 mp0 -112.91 -30.19 7.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.896 0.379 . . . . 75.140000000000001 110.861 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.515 ' NZ ' HG21 ' A' ' 57' ' ' ILE . 18.4 mtpp -94.1 153.77 17.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 74.219999999999999 110.872 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.2 t -129.24 115.34 35.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.267 -0.424 . . . . 74.340000000000003 111.144 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -80.76 144.21 32.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 73.099999999999994 110.898 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.501 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 72.0 m95 -135.04 163.22 30.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 74.409999999999997 110.902 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.9 ptt? -148.19 131.59 16.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 62.149999999999999 110.932 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.0 t -42.31 115.31 0.67 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.289 -0.414 . . . . 65.109999999999999 110.812 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 39.4 ptt85 -50.5 -18.96 0.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 73.400000000000006 110.886 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.692 ' CB ' HD12 ' A' ' 50' ' ' LEU . 6.2 m-20 -88.26 32.06 0.78 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.461 . . . . 74.430000000000007 110.87 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.582 ' NE2' ' HB2' ' A' ' 48' ' ' ALA . 1.2 pm0 -84.6 -14.53 48.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 73.0 110.865 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.582 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . . . -97.04 -46.3 6.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 61.539999999999999 111.133 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.1 ttt180 -84.48 -55.23 4.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.196 -0.456 . . . . 75.340000000000003 110.82 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.692 HD12 ' CB ' ' A' ' 46' ' ' ASP . 64.6 mt -88.07 9.56 22.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.289 -0.414 . . . . 74.530000000000001 110.957 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.8 35.48 2.18 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.746 -0.74 . . . . 62.520000000000003 112.47 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.423 ' N ' ' HA ' ' A' ' 47' ' ' GLN . 32.2 t -78.5 125.52 29.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.787 0.327 . . . . 70.310000000000002 110.878 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.65 19.31 18.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 63.140000000000001 110.863 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.7 t -69.64 125.67 27.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 64.340000000000003 110.855 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -122.48 159.52 27.48 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.164 -0.471 . . . . 54.140000000000001 110.91 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.561 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -151.74 149.48 29.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 35.140000000000001 111.075 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.515 HG21 ' NZ ' ' A' ' 39' ' ' LYS . 61.4 mt -117.7 131.08 71.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 74.109999999999999 111.139 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.639 HG22 HG13 ' A' ' 63' ' ' ILE . 30.1 p -115.66 144.69 43.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 64.239999999999995 111.217 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -130.39 94.66 3.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 72.120000000000005 110.96 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 78.55 -85.65 1.15 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.78 -0.724 . . . . 60.299999999999997 112.489 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 -128.07 5.29 5.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.768 0.318 . . . . 55.200000000000003 110.854 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -102.8 176.98 4.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.206 -0.452 . . . . 73.219999999999999 110.835 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.809 HD13 ' CG ' ' A' ' 25' ' ' HIS . 18.3 tt -150.79 149.82 13.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.126 -0.488 . . . . 74.200000000000003 111.115 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.561 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 53.7 mtm -138.27 140.12 39.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 75.120000000000005 110.862 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.401 ' CG2' ' NE2' ' A' ' 25' ' ' HIS . 66.8 t -99.43 142.21 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 71.209999999999994 111.101 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 29.0 mmm -103.4 -62.25 1.31 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 65.230000000000004 110.926 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 -114.99 -175.75 2.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.305 -0.407 . . . . 64.510000000000005 110.882 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.7 p -96.91 -175.57 3.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 74.239999999999995 110.892 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.453 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 69.5 m-70 -117.74 135.31 54.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 53.420000000000002 110.866 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.3 t -90.1 14.94 11.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 63.130000000000003 110.927 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.578 ' CG ' HD13 ' A' ' 50' ' ' LEU . 25.2 p80 -143.36 162.29 36.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 75.329999999999998 110.829 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -93.59 152.84 41.17 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.645 0.736 . . . . 71.329999999999998 110.874 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 154.92 67.18 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.702 2.268 . . . . 72.299999999999997 112.375 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.26 82.34 2.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 75.140000000000001 110.897 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.1 mt -53.79 -16.32 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 73.040000000000006 110.906 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.05 -52.6 13.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 53.020000000000003 111.102 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.9 -30.11 64.03 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.666 -0.778 . . . . 65.299999999999997 112.442 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.6 tp -73.03 -46.06 54.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.86 0.362 . . . . 64.400000000000006 110.922 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.57 -36.51 78.67 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.216 -0.447 . . . . 65.420000000000002 110.837 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.47 -32.11 66.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 62.229999999999997 111.115 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.6 mt -73.57 -42.69 61.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 74.420000000000002 110.903 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.675 ' CD ' HD11 ' A' ' 14' ' ' LEU . 1.6 mpp_? -76.49 -20.68 56.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 70.409999999999997 110.865 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -86.98 -38.15 16.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 65.409999999999997 110.963 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.28 -7.29 58.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 74.219999999999999 110.839 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -92.28 -64.15 1.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 71.120000000000005 110.829 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.2 mtp180 -65.03 174.53 1.91 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 42.109999999999999 110.909 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.719 ' C ' HD13 ' A' ' 87' ' ' LEU . 2.5 tm? . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 75.310000000000002 110.898 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.277 0 N-CA-C 112.457 -0.257 . . . . 61.0 112.457 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.0 t -133.7 160.27 38.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.838 0.352 . . . . 74.129999999999995 110.833 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.9 m -122.87 100.38 6.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 72.540000000000006 110.821 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.65 -123.67 5.31 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.761 -0.733 . . . . 62.229999999999997 112.453 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.5 m -136.16 149.14 48.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.843 0.354 . . . . 51.509999999999998 110.874 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.0 p -101.21 -179.86 4.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.127 -0.488 . . . . 71.319999999999993 110.881 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.89 -116.03 0.7 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.727 -0.749 . . . . 64.340000000000003 112.471 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.454 ' CD1' ' HB3' ' A' ' 62' ' ' ARG . 3.4 tp -113.7 101.61 9.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.806 0.336 . . . . 64.25 110.932 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.42 ' CD ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -75.22 144.5 78.73 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.605 0.717 . . . . 74.420000000000002 110.832 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.42 ' HD2' ' CD ' ' A' ' 9' ' ' ARG . 53.6 Cg_endo -69.72 -166.71 0.19 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.679 2.253 . . . . 44.210000000000001 112.338 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.659 HD21 HD11 ' A' ' 23' ' ' LEU . 11.7 tp -158.05 145.61 18.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 72.230000000000004 110.853 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -104.47 136.24 44.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.131 -0.486 . . . . 63.219999999999999 110.902 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.438 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 94.4 m-85 -126.85 163.4 23.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 73.239999999999995 110.904 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.8 HD12 ' CG2' ' A' ' 24' ' ' VAL . 1.4 mt -148.9 153.31 37.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.136 -0.483 . . . . 71.120000000000005 110.893 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 ppt_? -127.85 149.91 50.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 73.150000000000006 110.84 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.98 HG23 ' O ' ' A' ' 20' ' ' GLY . 2.3 p -107.21 -176.12 2.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 44.229999999999997 111.182 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.76 ' CB ' HD23 ' A' ' 18' ' ' LEU . 49.2 m -34.79 -75.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 74.439999999999998 110.848 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.76 HD23 ' CB ' ' A' ' 17' ' ' SER . 0.2 OUTLIER -131.3 139.98 49.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 72.030000000000001 110.928 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.428 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 35.83 68.46 0.28 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.723 -0.751 . . . . 63.240000000000002 112.506 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.98 ' O ' HG23 ' A' ' 16' ' ' THR . . . -157.23 75.57 0.21 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.755 -0.736 . . . . 75.510000000000005 112.444 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.1 tpp180 -96.5 116.93 29.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.738 0.304 . . . . 73.25 110.916 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -99.0 168.93 9.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 73.530000000000001 110.914 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.659 HD11 HD21 ' A' ' 11' ' ' LEU . 7.9 tp -123.85 114.13 19.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.112 -0.494 . . . . 72.430000000000007 110.894 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.8 ' CG2' HD12 ' A' ' 14' ' ' LEU . 43.0 t -90.74 110.75 22.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.45 . . . . 73.230000000000004 111.106 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.95 ' CG ' HD13 ' A' ' 63' ' ' ILE . 32.6 t60 -147.65 125.07 11.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 72.239999999999995 110.868 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 63.24 38.41 10.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.243 -0.435 . . . . 70.540000000000006 110.863 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.578 ' OG ' HD23 ' A' ' 75' ' ' LEU . 22.2 t 62.6 15.41 7.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 62.329999999999998 110.898 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -112.59 177.58 4.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.115 -0.493 . . . . 75.140000000000001 110.884 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.444 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 44.6 mt -132.46 129.7 39.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 55.039999999999999 110.927 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.499 ' HB2' HD23 ' A' ' 23' ' ' LEU . 1.2 m-85 -124.53 175.4 7.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 73.209999999999994 110.897 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 30.0 mtp180 -133.47 139.22 46.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 74.150000000000006 110.852 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -64.75 111.14 2.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 73.310000000000002 110.93 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -86.96 -57.91 2.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 75.510000000000005 110.909 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.75 167.89 27.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 54.130000000000003 110.881 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -127.38 131.61 50.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.224 -0.444 . . . . 61.32 111.093 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -117.71 100.05 7.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 62.049999999999997 111.129 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.33 -96.44 0.2 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.705 -0.76 . . . . 65.409999999999997 112.431 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -113.55 2.34 15.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.91 0.386 . . . . 72.430000000000007 110.896 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -105.07 157.6 17.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 75.5 110.847 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.5 t -136.66 116.67 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 44.200000000000003 111.137 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -79.09 146.71 33.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 73.510000000000005 110.956 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.509 ' CG ' HD22 ' A' ' 23' ' ' LEU . 69.1 m95 -136.51 167.38 21.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 71.310000000000002 110.981 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.6 ptt? -152.52 132.64 13.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.427 . . . . 71.040000000000006 110.86 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -45.43 113.93 0.67 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.215 -0.448 . . . . 73.439999999999998 110.893 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.448 ' NH2' HD11 ' A' ' 81' ' ' LEU . 18.0 ptt180 -54.89 -28.74 52.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 73.400000000000006 110.87 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.47 48.19 1.54 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 41.530000000000001 110.866 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -84.76 -37.04 21.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 74.129999999999995 110.95 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.17 -12.9 29.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 72.219999999999999 111.078 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.94 -40.99 7.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 72.530000000000001 110.855 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.641 HD13 ' CG ' ' A' ' 71' ' ' HIS . 90.3 mt -114.76 23.99 12.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 71.230000000000004 110.886 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.96 53.14 0.86 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.707 -0.759 . . . . 73.510000000000005 112.5 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.61 118.45 25.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.86 0.362 . . . . 75.439999999999998 110.897 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.8 mmt85 -105.58 50.23 0.78 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 73.329999999999998 110.815 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.3 t -87.33 117.26 25.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 74.120000000000005 110.806 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -105.15 161.55 14.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.141 -0.481 . . . . 73.439999999999998 110.902 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.782 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -148.08 163.01 38.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 64.150000000000006 111.059 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 70.2 mt -127.32 127.79 69.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 74.329999999999998 111.117 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.644 HG22 HG13 ' A' ' 63' ' ' ILE . 42.1 p -110.94 144.31 40.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 73.319999999999993 111.191 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -128.46 90.29 3.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.415 . . . . 74.030000000000001 110.995 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.95 -86.73 0.97 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.732 -0.747 . . . . 61.310000000000002 112.456 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -124.68 7.87 8.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.771 0.32 . . . . 73.120000000000005 110.854 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.454 ' HB3' ' CD1' ' A' ' 8' ' ' LEU . 10.3 ptt180 -105.82 180.0 4.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 72.340000000000003 110.831 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.95 HD13 ' CG ' ' A' ' 25' ' ' HIS . 17.5 tt -151.0 153.8 9.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 65.400000000000006 111.166 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.782 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 30.3 ttp -144.3 147.1 33.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 63.32 110.924 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 t -116.88 145.69 22.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 71.310000000000002 111.125 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 2.4 mtt -112.38 -62.31 1.59 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 72.299999999999997 110.871 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 -96.32 177.48 5.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.277 -0.42 . . . . 63.439999999999998 110.836 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.7 m -100.64 174.02 6.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 65.420000000000002 110.819 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.411 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 74.4 m-70 -107.88 127.69 53.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 73.209999999999994 110.85 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 8.2 t -82.53 14.74 2.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 73.420000000000002 110.897 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.641 ' CG ' HD13 ' A' ' 50' ' ' LEU . 27.8 p80 -145.12 153.12 41.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 75.040000000000006 110.842 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -86.8 152.49 54.01 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.621 0.724 . . . . 64.420000000000002 110.89 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 152.85 69.54 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.676 2.251 . . . . 60.130000000000003 112.377 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.55 90.95 3.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 52.039999999999999 110.878 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.578 HD23 ' OG ' ' A' ' 27' ' ' SER . 18.8 mt -58.69 -31.13 67.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 54.200000000000003 110.92 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -68.58 -31.97 71.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 63.210000000000001 111.153 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -88.54 -37.5 7.48 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.675 -0.774 . . . . 43.340000000000003 112.534 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.585 HD11 HG13 ' A' ' 24' ' ' VAL . 10.2 tp -72.6 -40.09 66.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.722 0.296 . . . . 72.129999999999995 110.892 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.567 ' N ' HH21 ' A' ' 82' ' ' ARG . 30.8 mm-40 -64.22 -30.35 71.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 63.219999999999999 110.867 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.412 ' O ' ' N ' ' A' ' 83' ' ' GLN . . . -65.12 -59.53 4.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 44.0 111.095 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.448 HD11 ' NH2' ' A' ' 45' ' ' ARG . 14.4 mt -39.47 -43.46 1.25 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.97 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.567 HH21 ' N ' ' A' ' 79' ' ' GLU . 55.6 mtm180 -65.29 -42.17 93.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.101 -0.5 . . . . 74.239999999999995 110.878 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.445 ' HG2' ' N ' ' A' ' 84' ' ' ARG . 1.3 pt20 -40.94 -33.65 0.33 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 71.230000000000004 110.962 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.445 ' N ' ' HG2' ' A' ' 83' ' ' GLN . 58.0 mtt180 -70.68 -45.55 64.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 73.340000000000003 110.852 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.23 -66.99 0.55 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.225 -0.443 . . . . 74.519999999999996 110.812 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.437 ' C ' ' CD ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -96.78 170.24 9.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 72.420000000000002 110.802 -179.857 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 14.0 tp . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 64.409999999999997 110.962 -179.987 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.493 -0.243 . . . . 33.030000000000001 112.493 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m 61.16 33.12 19.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.939 0.4 . . . . 70.209999999999994 110.871 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.4 t -119.58 65.01 0.8 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 53.109999999999999 110.911 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 111.41 95.56 2.29 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.808 -0.711 . . . . 72.510000000000005 112.511 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.6 p -138.43 119.81 14.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.886 0.374 . . . . 54.009999999999998 110.884 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 17.5 t -99.66 80.85 2.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 62.439999999999998 110.842 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 154.0 -43.95 0.59 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.684 -0.769 . . . . 54.520000000000003 112.428 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.408 ' CD1' ' HB3' ' A' ' 62' ' ' ARG . 28.3 tp -91.9 106.7 18.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.801 0.334 . . . . 63.009999999999998 110.965 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -81.29 145.77 56.58 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.561 0.696 . . . . 75.030000000000001 110.896 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -165.25 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.608 2.205 . . . . 71.129999999999995 112.294 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.869 HD21 HD11 ' A' ' 23' ' ' LEU . 25.9 tp -167.55 144.42 4.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 63.549999999999997 110.933 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.511 ' OE2' HG21 ' A' ' 24' ' ' VAL . 21.6 tt0 -102.32 150.0 23.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 73.340000000000003 110.908 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.436 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 37.1 m-85 -139.42 172.05 13.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.114 -0.494 . . . . 74.420000000000002 110.914 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.424 HD12 HD21 ' A' ' 29' ' ' LEU . 10.9 mt -144.45 151.78 39.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 73.040000000000006 110.94 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.4 ' HG2' ' CD ' ' A' ' 21' ' ' ARG . 79.1 mtm-85 -124.25 117.55 24.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.269 -0.423 . . . . 74.129999999999995 110.866 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.6 p -92.96 176.36 6.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 72.430000000000007 111.155 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 62.7 m -106.73 -68.99 0.85 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 64.340000000000003 110.839 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.6 mt -84.11 36.44 0.57 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 63.5 110.879 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.98 -105.85 0.3 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.743 -0.741 . . . . 72.230000000000004 112.451 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -162.64 -143.32 3.65 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.756 -0.735 . . . . 53.020000000000003 112.523 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.4 ' CD ' ' HG2' ' A' ' 15' ' ' ARG . 11.6 tpt180 -102.4 130.33 49.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.924 0.392 . . . . 74.239999999999995 110.842 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.434 ' HB3' HD22 ' A' ' 29' ' ' LEU . 2.7 m-85 -107.45 158.79 16.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 65.409999999999997 110.875 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.869 HD11 HD21 ' A' ' 11' ' ' LEU . 8.9 tp -125.1 114.64 19.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.16 -0.473 . . . . 73.349999999999994 110.91 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.511 HG21 ' OE2' ' A' ' 12' ' ' GLU . 53.5 t -87.96 119.46 35.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 74.150000000000006 111.124 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.915 ' CG ' HD13 ' A' ' 63' ' ' ILE . 25.2 t60 -156.45 126.17 6.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.247 -0.433 . . . . 71.439999999999998 110.937 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 61.53 41.07 12.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.234 -0.439 . . . . 75.030000000000001 110.87 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.413 ' HB2' ' CB ' ' A' ' 73' ' ' PRO . 10.3 m 58.37 32.44 22.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.091 -0.504 . . . . 74.310000000000002 110.858 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -131.41 -175.48 3.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 65.010000000000005 110.938 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.449 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 29.3 mt -140.63 133.23 28.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 74.299999999999997 110.886 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.51 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.1 m-85 -127.89 162.64 26.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 70.25 110.915 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.5 mtp180 -120.74 136.16 54.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 75.230000000000004 110.897 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.552 ' NZ ' ' HB2' ' A' ' 35' ' ' ALA . 38.5 tttp -58.66 112.07 1.49 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 62.43 110.97 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.44 ' OE1' ' NH2' ' A' ' 55' ' ' ARG . 1.6 tm-20 -82.87 -51.22 7.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.431 . . . . 73.099999999999994 110.937 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.57 ' HD3' ' CD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -158.52 179.12 9.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 74.340000000000003 110.898 179.935 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.552 ' HB2' ' NZ ' ' A' ' 32' ' ' LYS . . . -130.78 135.31 47.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 63.0 111.098 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -118.76 -172.58 2.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 51.009999999999998 111.111 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.25 92.12 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 74.239999999999995 112.478 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 66.71 43.24 2.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.917 0.389 . . . . 44.219999999999999 110.914 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -154.26 159.18 41.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 71.340000000000003 110.882 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.3 t -135.78 121.01 28.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 64.450000000000003 111.096 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.57 ' CD1' ' HD3' ' A' ' 34' ' ' LYS . 8.9 m-85 -85.39 149.12 25.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 75.230000000000004 110.914 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.437 ' CD1' HG23 ' A' ' 58' ' ' THR . 70.0 m95 -143.0 149.76 38.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 73.5 110.914 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -135.36 130.83 35.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 71.150000000000006 110.913 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.432 ' O ' ' N ' ' A' ' 46' ' ' ASP . 2.2 t -46.59 107.56 0.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 73.129999999999995 110.861 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.449 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.7 ptt-85 -40.23 -27.28 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 72.200000000000003 110.843 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 44' ' ' CYS . 0.3 OUTLIER -88.8 40.52 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 71.239999999999995 110.845 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -86.43 -37.46 18.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 73.519999999999996 110.909 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.62 -15.08 23.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 74.329999999999998 111.079 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.8 tpp180 -92.41 -61.93 1.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 63.340000000000003 110.89 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.1 mt -103.54 29.17 5.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 52.549999999999997 110.954 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.59 47.31 4.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.757 -0.735 . . . . 42.329999999999998 112.501 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.2 t -105.5 72.86 0.99 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.893 0.378 . . . . 65.329999999999998 110.931 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.474 ' HD3' ' N ' ' A' ' 54' ' ' SER . 0.0 OUTLIER -55.88 -13.88 2.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.12 -0.491 . . . . 75.400000000000006 110.828 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.474 ' N ' ' HD3' ' A' ' 53' ' ' ARG . 3.4 t -35.55 122.72 0.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 54.450000000000003 110.89 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.44 ' NH2' ' OE1' ' A' ' 33' ' ' GLU . 37.5 mtp180 -118.71 177.06 4.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 71.5 110.876 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.413 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -161.62 151.4 16.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 53.520000000000003 111.091 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.794 HD12 ' CE ' ' A' ' 66' ' ' MET . 61.7 mt -121.84 133.63 67.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 73.099999999999994 111.098 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.562 HG22 HG13 ' A' ' 63' ' ' ILE . 22.7 p -116.01 144.39 44.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 71.430000000000007 111.146 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -126.79 88.94 2.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 74.230000000000004 110.928 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 81.55 -86.92 1.39 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.711 -0.757 . . . . 72.329999999999998 112.417 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -126.03 8.12 7.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.752 0.31 . . . . 71.439999999999998 110.845 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.411 ' HG3' ' N ' ' A' ' 63' ' ' ILE . 8.2 ptm180 -106.42 179.82 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 71.109999999999999 110.867 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.915 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.95 151.73 12.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 65.239999999999995 111.162 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.433 ' N ' ' O ' ' A' ' 57' ' ' ILE . 3.9 mpp? -140.91 140.11 34.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 64.510000000000005 110.904 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.5 t -109.8 140.25 29.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 61.299999999999997 111.085 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.794 ' CE ' HD12 ' A' ' 57' ' ' ILE . 6.8 mmt -104.0 -53.78 2.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.153 -0.476 . . . . 73.209999999999994 110.864 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.3 mtp85 -115.05 167.67 10.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 74.409999999999997 110.93 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.0 m -86.54 -175.76 5.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 74.099999999999994 110.848 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 63.6 m-70 -118.85 137.3 53.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.17 -0.468 . . . . 64.5 110.841 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 16.6 t -91.29 9.99 29.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 51.200000000000003 110.786 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 33.0 p80 -138.23 157.3 46.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 75.329999999999998 110.916 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -89.96 156.49 46.81 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.599 0.714 . . . . 52.240000000000002 110.898 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.413 ' CB ' ' HB2' ' A' ' 27' ' ' SER . 54.0 Cg_endo -69.7 140.19 42.31 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.727 2.285 . . . . 61.340000000000003 112.335 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -102.53 80.95 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 71.030000000000001 110.903 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 57.2 mt -53.78 -16.47 1.74 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 62.340000000000003 110.963 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.22 -57.65 2.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.441 . . . . 53.039999999999999 111.073 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.79 -33.67 83.89 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.726 -0.749 . . . . 74.129999999999995 112.453 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.9 tp -70.53 -49.52 47.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.784 0.326 . . . . 75.420000000000002 110.936 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -62.24 -31.75 72.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 63.109999999999999 110.844 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.61 -54.57 22.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 73.099999999999994 111.063 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 15.8 mt -56.19 -32.39 64.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 60.439999999999998 110.928 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 6.5 mtp-105 -59.99 -36.04 76.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 75.219999999999999 110.917 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.414 ' HG3' ' N ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -57.48 -35.56 70.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.478 . . . . 73.299999999999997 110.852 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.458 ' CB ' ' CZ ' ' A' ' 84' ' ' ARG . 1.5 mtp-105 -69.66 -12.5 61.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 71.200000000000003 110.876 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 86' ' ' ARG . 2.6 tp10 -102.49 -52.64 3.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 62.109999999999999 110.933 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.42 ' N ' ' HG3' ' A' ' 85' ' ' GLU . 15.6 mmm180 -48.02 145.63 2.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.479 . . . . 63.32 110.867 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.73 HD22 ' C ' ' A' ' 87' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.225 -0.443 . . . . 71.540000000000006 110.88 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 112.495 -0.242 . . . . 54.539999999999999 112.495 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 t -72.01 145.79 48.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.888 0.375 . . . . 64.310000000000002 110.84 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 p -135.26 140.94 45.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.096 -0.502 . . . . 75.349999999999994 110.896 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.12 -178.61 36.15 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.711 -0.757 . . . . 70.510000000000005 112.455 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 t -93.53 155.57 17.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.814 0.34 . . . . 64.5 110.885 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.9 m -124.86 158.16 34.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 75.319999999999993 110.851 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 107.84 -106.43 2.39 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.767 -0.73 . . . . 53.420000000000002 112.461 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.541 HD12 ' HG3' ' A' ' 62' ' ' ARG . 6.0 tp -82.46 85.34 6.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.82 0.343 . . . . 72.310000000000002 110.94 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.466 ' N ' ' HD3' ' A' ' 62' ' ' ARG . 5.7 mtp-105 -75.87 144.13 75.73 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.526 0.679 . . . . 73.120000000000005 110.887 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.409 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 53.9 Cg_endo -69.68 -176.1 1.36 Allowed 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.669 2.246 . . . . 64.109999999999999 112.36 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.908 HD21 HD11 ' A' ' 23' ' ' LEU . 22.6 tp -135.12 154.06 51.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 60.219999999999999 110.925 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.468 ' C ' ' CD1' ' A' ' 13' ' ' PHE . 4.8 tp10 -118.57 150.03 40.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 72.140000000000001 110.881 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.756 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 1.9 m-85 -139.97 168.05 20.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 74.030000000000001 110.865 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.687 HD21 ' HG2' ' A' ' 82' ' ' ARG . 8.6 mt -135.26 117.24 15.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.17 -0.468 . . . . 72.409999999999997 110.896 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.3 ttt-85 -72.35 135.66 45.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 55.450000000000003 110.842 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.424 ' OG1' ' N ' ' A' ' 20' ' ' GLY . 1.1 p -116.58 168.13 10.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 61.210000000000001 111.122 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.3 t -107.87 -52.48 2.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.181 -0.463 . . . . 71.530000000000001 110.854 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mt -66.65 -55.09 16.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 72.310000000000002 110.938 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -84.33 -103.77 0.59 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.746 -0.74 . . . . 74.450000000000003 112.445 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.424 ' N ' ' OG1' ' A' ' 16' ' ' THR . . . -155.38 -102.51 0.2 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.708 -0.758 . . . . 72.030000000000001 112.444 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 tpp85 -119.88 150.1 41.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.856 0.36 . . . . 74.340000000000003 110.848 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -116.01 160.59 20.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 63.240000000000002 110.833 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.908 HD11 HD21 ' A' ' 11' ' ' LEU . 8.1 tp -122.63 113.89 19.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.065 -0.516 . . . . 73.219999999999999 110.908 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 88.8 t -88.6 117.57 32.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 73.530000000000001 111.115 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.77 ' CG ' HD13 ' A' ' 63' ' ' ILE . 8.4 t60 -153.22 124.88 7.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 70.299999999999997 110.889 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 62.17 45.3 7.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.278 -0.419 . . . . 32.219999999999999 110.909 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 53.61 21.95 2.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.139 -0.482 . . . . 70.239999999999995 110.831 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -119.57 -179.95 4.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 63.43 110.902 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' C ' ' CD1' ' A' ' 30' ' ' TYR . 43.6 mt -129.91 136.99 50.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 74.319999999999993 110.924 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.519 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -133.6 167.06 21.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 73.420000000000002 110.936 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.8 mtp180 -130.34 138.27 50.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 72.420000000000002 110.874 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 31.4 tttm -57.12 119.92 7.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.219 -0.446 . . . . 74.129999999999995 110.897 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -95.83 -55.09 3.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.282 -0.417 . . . . 74.140000000000001 110.876 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 45.5 pttt -151.13 178.68 8.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.107 -0.497 . . . . 75.329999999999998 110.864 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.02 121.21 15.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 54.109999999999999 111.19 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.4 56.74 3.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 63.140000000000001 111.094 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.31 -65.75 3.77 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.739 -0.743 . . . . 60.32 112.492 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -117.37 -20.87 8.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.883 0.373 . . . . 72.040000000000006 110.87 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.4 mtmm -93.4 161.32 14.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 75.040000000000006 110.937 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 t -137.03 116.12 15.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.29 -0.414 . . . . 74.209999999999994 111.12 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.435 ' CE2' HD11 ' A' ' 57' ' ' ILE . 6.3 m-85 -81.67 149.78 28.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 65.019999999999996 110.929 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.61 ' CG ' HD22 ' A' ' 23' ' ' LEU . 62.9 m95 -138.75 158.59 43.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.102 -0.499 . . . . 64.420000000000002 110.857 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 7.0 ptt? -142.24 137.97 31.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 73.310000000000002 110.867 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.41 ' C ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -46.42 108.39 0.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 74.400000000000006 110.906 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -44.4 -22.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 71.129999999999995 110.848 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.41 ' N ' ' C ' ' A' ' 44' ' ' CYS . 0.5 OUTLIER -84.09 35.79 0.54 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.438 . . . . 70.420000000000002 110.904 179.945 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 12.3 tp60 -48.27 -65.28 0.59 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.182 -0.463 . . . . 54.350000000000001 110.941 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -92.56 -33.07 14.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.226 -0.443 . . . . 73.129999999999995 111.096 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.75 -46.2 70.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.235 -0.439 . . . . 61.210000000000001 110.928 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 58.7 mt -123.69 25.93 7.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 63.5 110.872 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 39.36 43.94 2.16 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.694 -0.765 . . . . 64.349999999999994 112.529 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.4 t -96.89 148.24 23.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.35 . . . . 74.319999999999993 110.854 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.79 33.91 3.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.182 -0.463 . . . . 73.239999999999995 110.902 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.409 ' HG ' ' CD2' ' A' ' 69' ' ' HIS . 32.5 t -84.9 118.18 24.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 73.430000000000007 110.854 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -112.29 146.55 38.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 64.420000000000002 110.837 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.652 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -137.41 157.33 46.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 64.200000000000003 111.139 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.435 HD11 ' CE2' ' A' ' 41' ' ' TYR . 84.7 mt -123.18 126.16 73.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 51.520000000000003 111.074 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.507 HG23 ' CD1' ' A' ' 42' ' ' TRP . 43.0 p -102.02 152.15 21.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 62.520000000000003 111.131 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.8 tm0? -154.61 108.03 2.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 73.450000000000003 110.87 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.02 -97.35 0.92 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.774 -0.727 . . . . 72.140000000000001 112.571 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.409 ' CD2' ' HA ' ' A' ' 10' ' ' PRO . 1.7 t60 -128.77 11.25 6.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.812 0.339 . . . . 74.549999999999997 110.81 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.541 ' HG3' HD12 ' A' ' 8' ' ' LEU . 11.0 mmm180 -117.63 176.4 5.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 75.329999999999998 110.863 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.77 HD13 ' CG ' ' A' ' 25' ' ' HIS . 21.2 tt -143.92 159.43 16.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 62.43 111.147 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.652 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 5.6 ttp -135.72 148.97 49.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 75.120000000000005 110.914 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.6 t -120.13 142.61 35.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 43.530000000000001 111.139 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.4 mtp -117.73 -63.48 1.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 62.200000000000003 110.888 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -89.61 171.24 9.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 74.319999999999993 110.809 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -103.44 174.04 6.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.102 -0.499 . . . . 73.120000000000005 110.841 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.449 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 62.2 m-70 -110.09 132.66 53.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.49 . . . . 72.120000000000005 110.837 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 2.1 t -90.26 13.87 14.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 44.520000000000003 110.896 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -140.33 156.9 46.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 62.240000000000002 110.816 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -92.49 155.3 42.37 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 121.565 0.697 . . . . 51.420000000000002 110.883 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 162.23 42.87 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.659 2.239 . . . . 74.25 112.327 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.36 79.93 1.73 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 74.430000000000007 110.829 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.0 mt -46.35 -23.24 0.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 71.219999999999999 110.955 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.59 -40.93 72.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 45.130000000000003 111.111 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -80.44 -40.5 12.94 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.754 -0.736 . . . . 64.310000000000002 112.48 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.1 tp -65.77 -39.63 91.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.78 0.324 . . . . 54.140000000000001 110.909 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -63.64 -31.95 73.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 74.510000000000005 110.9 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.67 -31.57 72.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.491 . . . . 75.340000000000003 111.097 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.47 HD23 ' CZ ' ' A' ' 84' ' ' ARG . 9.8 mt -79.35 -28.26 42.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 73.219999999999999 110.934 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.687 ' HG2' HD21 ' A' ' 14' ' ' LEU . 69.5 mtp180 -80.24 -35.19 36.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 74.450000000000003 110.84 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.416 ' HG3' ' N ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -59.45 -34.78 72.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 62.420000000000002 110.97 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.47 ' CZ ' HD23 ' A' ' 81' ' ' LEU . 10.1 ptt180 -83.92 -4.32 58.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 64.340000000000003 110.838 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -103.14 -30.24 10.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 75.430000000000007 110.857 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -103.55 73.41 1.19 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 72.239999999999995 110.879 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.8 tp . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.123 -0.49 . . . . 64.310000000000002 110.943 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 N-CA-C 112.5 -0.24 . . . . 73.200000000000003 112.5 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.4 p -120.25 116.1 24.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.954 0.407 . . . . 73.010000000000005 110.857 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.6 t -107.49 -16.13 14.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.09 -0.504 . . . . 70.109999999999999 110.834 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 151.89 -161.32 29.25 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.713 -0.756 . . . . 72.099999999999994 112.508 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.0 t -115.1 122.47 46.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.905 0.383 . . . . 53.030000000000001 110.802 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.2 t -122.08 164.83 17.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.086 -0.506 . . . . 71.510000000000005 110.857 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.63 -21.08 74.53 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.824 -0.703 . . . . 61.030000000000001 112.436 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.716 HD12 ' HG3' ' A' ' 62' ' ' ARG . 6.5 tp -71.14 88.77 0.81 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.852 0.358 . . . . 61.020000000000003 110.96 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 -81.31 144.03 53.11 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.584 0.707 . . . . 74.400000000000006 110.85 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 178.82 4.16 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.67 2.246 . . . . 72.340000000000003 112.382 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.95 HD21 HD11 ' A' ' 23' ' ' LEU . 20.7 tp -140.82 150.02 42.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 72.209999999999994 110.877 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -107.31 151.67 25.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 65.010000000000005 110.849 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.613 ' CE2' HD13 ' A' ' 23' ' ' LEU . 72.1 m-85 -137.22 172.96 12.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.121 -0.49 . . . . 75.450000000000003 110.83 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.493 HD12 HD21 ' A' ' 29' ' ' LEU . 16.6 mt -147.81 174.1 12.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.088 -0.506 . . . . 75.450000000000003 110.937 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -127.78 150.07 49.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 62.350000000000001 110.816 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.6 p -107.84 172.22 6.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.157 -0.474 . . . . 73.420000000000002 111.083 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.4 m -75.31 -65.87 0.84 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 62.229999999999997 110.824 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.511 ' N ' ' CD2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -68.24 71.15 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 75.329999999999998 110.932 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.439 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 34.72 83.94 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.745 -0.74 . . . . 61.439999999999998 112.533 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -158.75 170.91 35.34 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.751 -0.737 . . . . 71.510000000000005 112.5 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.407 ' CD ' ' O ' ' A' ' 14' ' ' LEU . 12.1 tpt180 -141.23 135.66 30.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.786 0.327 . . . . 54.219999999999999 110.916 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -107.42 158.67 16.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 62.43 110.936 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.95 HD11 HD21 ' A' ' 11' ' ' LEU . 13.1 tp -124.11 115.96 22.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.466 . . . . 74.209999999999994 110.935 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.3 t -90.35 115.51 29.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 64.010000000000005 111.086 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.877 ' CG ' HD13 ' A' ' 63' ' ' ILE . 29.7 t60 -153.49 132.77 12.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 74.310000000000002 110.809 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 60.02 33.16 21.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 75.439999999999998 110.967 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.8 m 65.43 29.23 11.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.119 -0.491 . . . . 52.539999999999999 110.909 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -130.74 -174.68 3.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.109 -0.496 . . . . 63.520000000000003 110.848 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.493 HD21 HD12 ' A' ' 14' ' ' LEU . 9.8 mt -138.86 132.7 30.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.108 -0.496 . . . . 74.049999999999997 110.967 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.522 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -125.96 166.92 16.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.19 -0.459 . . . . 75.099999999999994 110.973 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -126.29 126.42 43.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.132 -0.486 . . . . 73.010000000000005 110.843 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -45.18 108.58 0.13 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.151 -0.477 . . . . 45.409999999999997 110.878 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -82.89 -53.41 5.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 71.299999999999997 110.927 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.466 ' HD3' ' CD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -159.16 178.8 9.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.083 -0.508 . . . . 74.310000000000002 110.923 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -130.52 128.61 41.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.446 . . . . 63.539999999999999 111.068 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.41 19.91 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 75.140000000000001 111.07 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 90.86 -49.65 3.1 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.731 -0.747 . . . . 51.229999999999997 112.472 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -111.32 -18.83 12.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.922 0.391 . . . . 71.209999999999994 110.866 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.464 ' HB3' ' CG2' ' A' ' 57' ' ' ILE . 9.9 mtmm -123.02 170.64 9.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.236 -0.438 . . . . 73.540000000000006 110.938 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.441 ' O ' ' CD1' ' A' ' 42' ' ' TRP . 4.7 t -133.53 119.13 33.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.236 -0.438 . . . . 65.530000000000001 111.114 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.466 ' CD1' ' HD3' ' A' ' 34' ' ' LYS . 2.9 m-85 -75.79 150.3 37.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.113 -0.494 . . . . 74.420000000000002 110.922 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.734 ' CD1' HG23 ' A' ' 58' ' ' THR . 75.3 m95 -142.92 121.96 12.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.106 -0.497 . . . . 64.299999999999997 110.892 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.463 ' SD ' ' NE2' ' A' ' 47' ' ' GLN . 16.3 ptt? -106.26 136.06 46.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.239 -0.437 . . . . 44.25 110.877 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.6 t -50.4 113.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 74.140000000000001 110.924 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.43 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 20.7 ptt-85 -44.66 -35.16 2.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 74.230000000000004 110.927 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.69 44.31 0.62 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 74.420000000000002 110.902 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.463 ' NE2' ' SD ' ' A' ' 43' ' ' MET . 24.6 pt20 -88.77 -26.18 21.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 75.439999999999998 110.914 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.77 -30.72 12.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 55.310000000000002 111.106 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 49' ' ' ARG . 4.5 ttp-105 -89.04 -62.34 1.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 70.040000000000006 110.855 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.5 mt -90.37 20.31 4.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 62.210000000000001 110.867 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 36.72 36.88 0.19 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.721 -0.752 . . . . 44.119999999999997 112.512 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.7 t -89.33 120.67 30.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.791 0.329 . . . . 74.439999999999998 110.877 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 40.8 mmm-85 -98.75 13.75 31.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.456 . . . . 73.230000000000004 110.857 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.507 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 23.2 t -61.26 108.21 0.88 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 74.540000000000006 110.94 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.43 ' CB ' ' CZ ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -111.08 164.33 12.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 70.010000000000005 110.868 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.735 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -157.23 159.93 38.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.420000000000002 111.13 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.464 ' CG2' ' HB3' ' A' ' 39' ' ' LYS . 74.6 mt -123.98 128.49 74.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.234 -0.439 . . . . 72.310000000000002 111.16 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.734 HG23 ' CD1' ' A' ' 42' ' ' TRP . 30.0 p -101.29 144.21 30.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 54.340000000000003 111.14 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.56 111.02 6.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 73.430000000000007 110.88 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 68.73 -94.77 0.36 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.717 -0.754 . . . . 64.319999999999993 112.505 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.479 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -128.68 7.28 5.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.832 0.348 . . . . 75.129999999999995 110.894 -179.973 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.716 ' HG3' HD12 ' A' ' 8' ' ' LEU . 10.3 mmm180 -112.41 178.82 4.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 64.109999999999999 110.872 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.877 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.2 tt -145.74 157.87 12.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 73.239999999999995 111.172 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.735 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 2.7 ttp -135.31 140.66 45.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 54.049999999999997 110.804 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.1 t -106.37 143.22 17.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 62.130000000000003 111.162 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.0 mtp -117.96 -55.21 2.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 74.439999999999998 110.897 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -110.75 144.91 38.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 74.310000000000002 110.828 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.3 p -75.39 168.71 19.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 74.439999999999998 110.783 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.507 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 72.6 m-70 -104.5 132.75 50.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.5 . . . . 74.049999999999997 110.833 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.6 t -86.21 11.95 10.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 55.43 110.853 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 25.9 p80 -140.2 154.96 47.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 74.450000000000003 110.858 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -89.52 152.36 47.17 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.67 0.747 . . . . 72.540000000000006 110.878 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 159.58 52.86 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.665 2.243 . . . . 71.219999999999999 112.365 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.48 85.68 2.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 44.219999999999999 110.892 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.2 mt -52.34 -18.17 1.48 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 65.420000000000002 110.918 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.6 -52.28 13.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 73.510000000000005 111.099 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -70.98 -34.96 64.94 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.666 -0.778 . . . . 21.239999999999998 112.571 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.1 tp -68.55 -42.04 78.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.802 0.334 . . . . 73.329999999999998 110.937 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.57 -40.81 97.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 64.319999999999993 110.891 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.95 -28.45 57.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.239999999999995 111.102 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.2 mt -81.59 -29.65 33.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.400000000000006 110.943 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 41.4 mtp180 -82.38 -31.63 29.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 61.420000000000002 110.901 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -59.09 -34.24 71.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 61.43 110.911 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -75.97 -8.49 57.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.171 -0.468 . . . . 75.209999999999994 110.833 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.408 ' HG3' ' CD2' ' A' ' 14' ' ' LEU . 3.8 mm-40 -94.81 -52.09 4.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.22 -0.445 . . . . 73.409999999999997 110.895 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.5 mtp-105 -78.06 141.05 39.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 63.539999999999999 110.906 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.79 HD22 ' C ' ' A' ' 87' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 72.140000000000001 110.907 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.515 -0.234 . . . . 24.300000000000001 112.515 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.4 p -129.25 97.57 4.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.924 0.392 . . . . 61.119999999999997 110.829 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 69.8 m -143.0 137.03 29.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 70.219999999999999 110.819 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.94 167.2 25.15 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.705 -0.76 . . . . 53.109999999999999 112.443 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.7 m -135.69 126.19 26.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.806 0.336 . . . . 74.329999999999998 110.878 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.0 p -136.67 144.09 43.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.177 -0.465 . . . . 51.32 110.868 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.36 19.48 42.56 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.75 -0.738 . . . . 73.140000000000001 112.426 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.853 HD23 ' O ' ' A' ' 8' ' ' LEU . 3.5 tt -143.48 105.42 4.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.859 0.361 . . . . 73.120000000000005 110.902 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 mmt-85 -76.53 144.04 73.17 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.614 0.721 . . . . 72.120000000000005 110.905 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.445 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 53.6 Cg_endo -69.7 -179.5 2.93 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.744 2.296 . . . . 51.409999999999997 112.314 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.758 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 23.7 tp -123.44 145.75 48.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 73.400000000000006 110.909 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -91.66 136.71 32.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 71.329999999999998 110.857 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.758 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 68.3 m-85 -136.82 169.65 17.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 73.430000000000007 110.898 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.418 HD21 ' HG2' ' A' ' 82' ' ' ARG . 12.8 mt -143.92 120.99 11.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 64.299999999999997 110.931 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -92.41 129.32 38.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 62.409999999999997 110.881 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.455 HG21 ' CE2' ' A' ' 22' ' ' PHE . 1.2 p -108.62 165.55 11.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 60.520000000000003 111.125 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.8 m -107.3 -29.74 9.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 75.140000000000001 110.862 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.3 mp -85.86 -60.43 2.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.138 -0.483 . . . . 71.299999999999997 110.882 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.45 -91.18 0.35 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.741 -0.742 . . . . 74.420000000000002 112.477 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -168.91 -113.56 0.29 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.688 -0.768 . . . . 74.420000000000002 112.468 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 ttp180 -109.85 150.86 27.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.798 0.333 . . . . 74.030000000000001 110.852 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.455 ' CE2' HG21 ' A' ' 16' ' ' THR . 3.3 m-85 -129.25 166.04 20.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 74.230000000000004 110.88 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.636 HD11 HD21 ' A' ' 11' ' ' LEU . 5.0 tp -133.18 113.42 12.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.171 -0.468 . . . . 52.539999999999999 110.91 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.4 t -88.06 119.53 35.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 65.239999999999995 111.164 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.646 ' CG ' HD13 ' A' ' 63' ' ' ILE . 4.7 t60 -155.85 132.38 10.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 75.319999999999993 110.821 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 58.19 36.72 26.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.282 -0.417 . . . . 64.5 110.851 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m 62.23 26.07 15.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 53.25 110.822 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -126.29 -178.63 4.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 74.040000000000006 110.923 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.528 ' CD1' ' CZ ' ' A' ' 45' ' ' ARG . 67.8 mt -132.75 136.19 46.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.477 . . . . 72.420000000000002 110.926 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.511 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -130.46 159.46 36.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 70.209999999999994 110.878 -179.944 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.458 ' NE ' ' HA ' ' A' ' 45' ' ' ARG . 3.0 mtt180 -113.96 136.81 52.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 75.439999999999998 110.881 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.4 tttt -61.28 108.67 0.96 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 64.519999999999996 110.892 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -81.01 -60.06 2.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.278 -0.419 . . . . 71.109999999999999 110.89 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 26.8 pttt -153.0 177.71 10.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 74.540000000000006 110.888 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -138.49 117.57 12.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.441 . . . . 64.120000000000005 111.134 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.8 91.75 4.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 34.119999999999997 111.142 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.25 -85.84 0.1 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.73 -0.748 . . . . 74.230000000000004 112.539 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -117.26 0.17 12.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.91 0.386 . . . . 74.129999999999995 110.879 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.623 ' HE3' HG21 ' A' ' 57' ' ' ILE . 55.8 mtpt -102.94 156.77 17.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 74.439999999999998 110.893 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.5 t -138.25 117.6 14.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.267 -0.424 . . . . 42.039999999999999 111.126 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.786 ' CE2' HD11 ' A' ' 57' ' ' ILE . 9.1 m-85 -82.07 146.64 29.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 74.150000000000006 110.952 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.559 ' CG ' HD22 ' A' ' 23' ' ' LEU . 71.8 m95 -137.3 159.64 41.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.13 -0.486 . . . . 75.219999999999999 110.904 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.1 ptt? -143.64 126.13 15.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 72.310000000000002 110.908 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -38.16 114.11 0.33 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.271 -0.422 . . . . 62.32 110.871 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.528 ' CZ ' ' CD1' ' A' ' 29' ' ' LEU . 20.2 ptt180 -52.64 -22.57 5.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 71.040000000000006 110.864 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.56 43.32 1.02 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 72.420000000000002 110.867 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -85.86 -35.51 20.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.456 . . . . 72.329999999999998 110.885 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.6 -9.3 27.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 45.149999999999999 111.103 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 ttm-85 -98.29 -54.7 2.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 74.239999999999995 110.864 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.3 mt -110.05 26.46 10.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 71.239999999999995 110.886 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.14 47.38 4.33 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.757 -0.735 . . . . 64.420000000000002 112.494 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.1 t -94.94 147.08 23.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.747 0.308 . . . . 72.140000000000001 110.918 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.406 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -132.07 26.65 4.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 74.439999999999998 110.857 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.0 t -78.07 109.53 12.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 73.510000000000005 110.828 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.406 ' NH1' ' HB2' ' A' ' 53' ' ' ARG . 9.7 mpt_? -103.75 158.29 16.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.329999999999998 110.915 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -149.13 161.39 42.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 75.439999999999998 111.064 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.786 HD11 ' CE2' ' A' ' 41' ' ' TYR . 40.6 mt -127.19 121.57 57.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 55.009999999999998 111.12 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.5 p -102.58 143.71 31.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.49 . . . . 73.129999999999995 111.127 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -129.25 87.05 2.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.243 -0.435 . . . . 70.209999999999994 110.944 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.81 -82.26 1.09 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.742 -0.742 . . . . 73.040000000000006 112.509 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.683 ' HB2' HD21 ' A' ' 8' ' ' LEU . 3.5 m-70 -127.75 9.59 6.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.709 0.29 . . . . 65.409999999999997 110.794 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -111.68 170.49 8.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.169 -0.468 . . . . 63.030000000000001 110.896 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.646 HD13 ' CG ' ' A' ' 25' ' ' HIS . 5.7 tt -148.13 145.46 18.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 72.209999999999994 111.139 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.49 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 4.0 mpp? -132.7 133.31 43.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 71.329999999999998 110.897 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.2 t -104.45 130.0 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.416 . . . . 73.230000000000004 111.082 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.443 ' CE ' HD12 ' A' ' 57' ' ' ILE . 10.4 mmt -102.46 -62.82 1.22 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 61.299999999999997 110.858 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.21 172.93 8.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.272 -0.422 . . . . 72.409999999999997 110.842 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -106.24 168.07 9.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 53.0 110.919 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.425 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 48.0 m-70 -105.19 130.98 53.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 72.319999999999993 110.899 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.9 t -88.51 11.93 15.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.208 -0.451 . . . . 41.539999999999999 110.877 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -137.48 161.0 37.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 63.210000000000001 110.827 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -97.22 151.95 37.99 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.55 0.691 . . . . 75.409999999999997 110.963 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 154.08 68.29 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.699 2.266 . . . . 61.509999999999998 112.369 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -131.36 79.67 1.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.182 -0.463 . . . . 72.010000000000005 110.845 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.6 mt -44.18 -23.43 0.1 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 73.219999999999999 110.868 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.99 -47.82 67.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.451 . . . . 61.140000000000001 111.138 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.52 -35.58 59.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.704 -0.76 . . . . 73.040000000000006 112.548 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -71.01 -35.35 72.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.727 0.299 . . . . 62.130000000000003 110.906 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -74.6 -25.05 59.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 75.409999999999997 110.879 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.93 -31.09 69.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 74.439999999999998 111.087 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.0 mt -86.39 -32.05 21.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.266 -0.424 . . . . 54.020000000000003 110.92 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.418 ' HG2' HD21 ' A' ' 14' ' ' LEU . 3.6 mtp-105 -74.71 -38.03 62.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 75.439999999999998 110.813 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.404 ' CG ' ' N ' ' A' ' 84' ' ' ARG . 1.0 OUTLIER -58.29 -42.37 86.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.254 -0.43 . . . . 74.549999999999997 110.921 -179.954 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.404 ' N ' ' CG ' ' A' ' 83' ' ' GLN . 1.1 ptm180 -67.54 -16.45 64.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 73.140000000000001 110.906 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -98.01 -72.26 0.66 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 65.400000000000006 110.861 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -88.13 130.04 35.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.101 -0.499 . . . . 74.299999999999997 110.876 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 25.1 tp . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.16 -0.473 . . . . 72.040000000000006 110.944 179.973 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.248 0 N-CA-C 112.465 -0.254 . . . . 74.439999999999998 112.465 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -153.86 149.1 27.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.861 0.363 . . . . 75.099999999999994 110.84 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.5 p -126.97 142.89 51.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.138 -0.483 . . . . 52.219999999999999 110.871 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -142.82 -156.98 6.97 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.676 -0.773 . . . . 44.420000000000002 112.418 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.1 m -113.79 27.1 9.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.871 0.367 . . . . 62.009999999999998 110.846 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.7 t -105.74 142.53 35.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 54.509999999999998 110.843 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 8' ' ' LEU . . . 52.23 -177.72 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.65 -0.786 . . . . 64.329999999999998 112.5 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.955 HD13 ' HG3' ' A' ' 62' ' ' ARG . 0.7 OUTLIER -34.28 143.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.821 0.343 . . . . 74.319999999999993 110.922 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.67 ' O ' HD12 ' A' ' 8' ' ' LEU . 69.6 mtt180 -79.45 144.02 60.78 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.614 0.721 . . . . 74.540000000000006 110.849 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -167.89 0.25 Allowed 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.636 2.224 . . . . 75.140000000000001 112.317 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.62 HD21 HD11 ' A' ' 23' ' ' LEU . 14.0 tp -142.91 145.16 32.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 40.109999999999999 110.95 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.593 ' OE2' HG11 ' A' ' 24' ' ' VAL . 31.8 tt0 -90.5 139.94 30.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 61.219999999999999 110.883 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.482 ' CZ ' ' HB3' ' A' ' 11' ' ' LEU . 68.7 m-85 -138.88 169.53 17.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.13 -0.487 . . . . 71.420000000000002 110.817 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.851 HD21 ' HG3' ' A' ' 82' ' ' ARG . 14.8 mt -142.3 162.01 36.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 71.129999999999995 110.873 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 45.4 mtp180 -128.0 149.8 50.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 73.439999999999998 110.911 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.2 p -107.04 168.13 9.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 74.239999999999995 111.135 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.8 t -82.82 -31.46 28.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 64.439999999999998 110.831 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.71 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -101.84 70.87 1.26 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.479 . . . . 54.039999999999999 110.929 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.413 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 37.1 91.63 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.765 -0.731 . . . . 61.310000000000002 112.504 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -173.81 153.85 18.28 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.725 -0.75 . . . . 62.119999999999997 112.504 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.7 ttm180 -131.74 137.89 48.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 70.549999999999997 110.849 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -116.88 157.8 25.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 75.120000000000005 110.841 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.62 HD11 HD21 ' A' ' 11' ' ' LEU . 13.6 tp -120.84 117.08 26.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 75.239999999999995 110.853 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.593 HG11 ' OE2' ' A' ' 12' ' ' GLU . 93.7 t -92.31 117.33 35.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 61.210000000000001 111.132 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.687 ' CG ' HD13 ' A' ' 63' ' ' ILE . 5.7 t60 -153.52 127.76 9.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.462 . . . . 74.549999999999997 110.828 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 61.23 41.63 13.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 74.200000000000003 110.884 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.4 m 54.84 35.56 24.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 60.310000000000002 110.848 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.412 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 19.1 m-85 -133.03 -176.76 4.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 62.409999999999997 110.91 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.619 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 56.5 mt -133.66 132.66 40.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 63.130000000000003 110.951 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.517 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -128.43 169.06 14.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 74.450000000000003 110.921 -179.925 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.46 ' HB3' ' CZ ' ' A' ' 31' ' ' ARG . 2.1 mtp-105 -129.69 142.99 50.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 73.349999999999994 110.889 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -64.13 109.02 1.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 75.109999999999999 110.903 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -83.06 -55.08 4.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 60.130000000000003 110.853 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.0 pttt -153.36 -176.13 5.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 62.030000000000001 110.927 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.75 128.05 22.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 74.099999999999994 111.129 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' A' ' 38' ' ' GLU . . . -114.07 -177.12 3.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 63.340000000000003 111.053 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -42.7 95.31 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.678 -0.772 . . . . 35.149999999999999 112.449 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 36' ' ' ALA . 7.0 mp0 55.6 42.65 29.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.94 0.4 . . . . 74.099999999999994 110.873 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.527 ' HD2' HG21 ' A' ' 57' ' ' ILE . 39.6 mtmt -150.12 160.68 43.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.218 -0.446 . . . . 62.420000000000002 110.833 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.5 t -138.94 121.0 17.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 62.140000000000001 111.133 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -85.3 139.42 31.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 75.099999999999994 110.903 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.545 ' CG ' HD22 ' A' ' 23' ' ' LEU . 74.1 m95 -129.55 157.04 43.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.131 -0.486 . . . . 74.329999999999998 110.924 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 20.3 ptt? -144.07 136.25 26.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 72.409999999999997 110.819 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.4 t -46.39 114.95 0.9 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 61.420000000000002 110.832 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.619 ' CZ ' HD13 ' A' ' 29' ' ' LEU . 19.0 ptt180 -55.18 -21.43 13.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.118 -0.492 . . . . 72.510000000000005 110.883 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.33 36.6 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 74.019999999999996 110.892 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -80.54 -36.45 33.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 71.140000000000001 110.927 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.43 -15.33 25.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.185 -0.461 . . . . 64.400000000000006 111.046 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.5 ttm180 -98.79 -62.12 1.28 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 73.010000000000005 110.806 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.437 HD13 ' CG ' ' A' ' 71' ' ' HIS . 95.4 mt -97.28 26.84 4.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 72.299999999999997 110.939 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.02 47.72 1.03 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.753 -0.736 . . . . 70.230000000000004 112.538 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 7.6 t -95.65 148.96 21.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.771 0.32 . . . . 74.120000000000005 110.895 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 27.7 mmm180 -124.83 8.25 8.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 75.439999999999998 110.937 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.462 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 22.8 t -58.36 147.13 32.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 50.409999999999997 110.845 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 46.9 mtt180 -146.98 164.2 33.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 72.129999999999995 110.862 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.675 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -152.43 153.81 34.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 73.019999999999996 111.149 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.527 HG21 ' HD2' ' A' ' 39' ' ' LYS . 85.8 mt -119.25 126.22 75.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.23 -0.441 . . . . 62.329999999999998 111.058 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.544 HG22 HG13 ' A' ' 63' ' ' ILE . 49.7 p -103.05 144.69 30.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 72.099999999999994 111.144 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -133.81 87.11 2.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 73.349999999999994 110.925 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.9 -86.62 1.55 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 63.240000000000002 112.472 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.922 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -128.11 -5.59 5.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.75 0.31 . . . . 72.120000000000005 110.832 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.955 ' HG3' HD13 ' A' ' 8' ' ' LEU . 11.1 mtm105 -96.4 -178.32 4.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 73.209999999999994 110.885 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.687 HD13 ' CG ' ' A' ' 25' ' ' HIS . 8.5 tt -150.63 156.44 6.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 74.430000000000007 111.156 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.675 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 1.6 ttp -143.26 144.78 32.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 72.5 110.892 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 86.3 t -102.08 148.64 7.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.227 -0.442 . . . . 74.030000000000001 111.14 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 19.1 mtm -119.23 -62.15 1.55 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 71.109999999999999 110.899 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.9 mtt85 -103.11 164.31 11.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 72.299999999999997 110.921 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.2 m -90.86 175.34 7.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 75.25 110.903 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.462 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 65.1 m-70 -112.88 134.6 54.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 73.109999999999999 110.895 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.6 m -92.0 13.42 18.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.465 . . . . 53.210000000000001 110.956 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.437 ' CG ' HD13 ' A' ' 50' ' ' LEU . 31.0 p80 -139.67 166.3 24.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.133 -0.485 . . . . 75.129999999999995 110.876 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -95.66 153.72 39.34 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.635 0.731 . . . . 71.439999999999998 110.963 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.412 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.74 152.7 69.48 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.73 2.286 . . . . 71.25 112.312 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -114.37 75.67 0.94 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 74.450000000000003 110.912 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.6 mt -49.56 -19.76 0.64 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.242 -0.435 . . . . 71.310000000000002 110.927 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.02 -50.01 6.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 50.140000000000001 111.073 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.76 -34.01 88.78 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.744 -0.741 . . . . 64.430000000000007 112.472 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -73.65 -44.49 56.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.823 0.344 . . . . 74.409999999999997 111.0 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.64 -26.76 68.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 71.530000000000001 110.875 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.82 -55.57 14.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 72.5 111.129 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.5 mt -46.51 -49.32 18.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 54.329999999999998 110.946 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.851 ' HG3' HD21 ' A' ' 14' ' ' LEU . 9.1 mtt-85 -58.23 -35.44 71.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 74.319999999999993 110.881 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.431 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 1.7 tp60 -75.72 -21.97 57.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 73.450000000000003 110.938 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 58.1 mtp85 -86.78 -20.3 27.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 74.549999999999997 110.91 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.837 ' OE2' HD22 ' A' ' 14' ' ' LEU . 33.3 mt-10 -82.51 -72.77 0.43 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 63.119999999999997 110.915 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.438 ' CB ' ' CZ ' ' A' ' 86' ' ' ARG . 3.9 mtp-105 -88.7 165.07 14.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 74.439999999999998 110.893 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.3 tp . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 116.167 -0.469 . . . . 71.209999999999994 110.904 -179.968 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.49 -0.244 . . . . 72.319999999999993 112.49 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.7 t -116.15 147.19 41.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.855 0.359 . . . . 62.5 110.84 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 89.9 p -118.09 165.18 14.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 72.010000000000005 110.869 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.77 -167.5 1.1 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.651 -0.785 . . . . 72.549999999999997 112.558 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.5 p -127.77 -61.31 1.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.833 0.349 . . . . 73.239999999999995 110.793 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m -94.02 80.92 4.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 52.399999999999999 110.828 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -145.88 158.77 27.78 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.747 -0.74 . . . . 72.319999999999993 112.444 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.841 HD12 ' HD3' ' A' ' 62' ' ' ARG . 3.5 tp -112.23 97.2 6.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.824 0.345 . . . . 64.319999999999993 110.899 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -91.46 145.18 30.84 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.553 0.692 . . . . 70.0 110.893 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.492 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 52.9 Cg_endo -69.8 -178.45 2.36 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.735 2.29 . . . . 72.219999999999999 112.354 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.807 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 18.0 tp -140.9 153.64 45.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 71.25 110.875 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -110.89 140.44 45.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.158 -0.474 . . . . 72.349999999999994 110.899 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.807 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 8.6 m-85 -137.33 172.96 12.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.474 . . . . 72.310000000000002 110.89 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.907 HD21 ' HG3' ' A' ' 82' ' ' ARG . 3.7 mt -148.04 160.23 43.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.19 -0.459 . . . . 75.150000000000006 110.906 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 -116.84 148.59 41.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 65.209999999999994 110.848 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.9 p -115.28 134.7 54.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.182 -0.463 . . . . 75.510000000000005 111.155 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.0 t -64.96 -43.56 92.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.223 -0.444 . . . . 65.319999999999993 110.832 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mt -50.14 -19.07 0.67 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 43.030000000000001 110.89 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 109.55 73.82 0.78 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.716 -0.754 . . . . 63.100000000000001 112.541 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -177.11 -179.67 47.57 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.784 -0.722 . . . . 53.200000000000003 112.502 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -131.87 148.04 52.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.784 0.326 . . . . 62.229999999999997 110.892 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -123.95 160.89 26.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 74.209999999999994 110.928 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.796 HD11 HD21 ' A' ' 11' ' ' LEU . 10.9 tp -122.56 118.69 28.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.205 -0.452 . . . . 72.140000000000001 110.918 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.684 ' CG2' HD12 ' A' ' 14' ' ' LEU . 24.2 t -94.79 108.22 20.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 63.450000000000003 111.166 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.832 ' CG ' HD13 ' A' ' 63' ' ' ILE . 50.1 t60 -145.12 134.14 22.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 73.299999999999997 110.86 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 59.54 33.18 22.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 71.140000000000001 110.94 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.1 m 65.3 25.39 12.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 75.340000000000003 110.854 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.497 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 15.4 m-85 -127.84 179.18 5.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 72.239999999999995 110.875 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.485 HD11 HD12 ' A' ' 81' ' ' LEU . 11.2 mt -128.37 133.14 48.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.144 -0.48 . . . . 64.510000000000005 110.931 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.505 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.1 m-85 -124.57 164.19 20.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.244 -0.435 . . . . 75.040000000000006 110.906 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.2 mtp180 -123.23 134.34 54.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 74.129999999999995 110.85 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 34.4 tttm -59.93 110.02 1.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 72.439999999999998 110.84 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -85.0 -54.08 4.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 73.319999999999993 110.916 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.415 ' CG ' ' HB2' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -146.55 171.26 15.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 72.5 110.881 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -133.39 115.01 14.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 64.030000000000001 111.125 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.408 ' O ' ' C ' ' A' ' 37' ' ' GLY . . . -89.14 -175.62 4.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 51.039999999999999 111.159 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.408 ' C ' ' O ' ' A' ' 36' ' ' ALA . . . -37.59 -72.48 0.17 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.761 -0.733 . . . . 24.149999999999999 112.444 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -125.76 39.78 3.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.945 0.402 . . . . 75.439999999999998 110.933 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.66 ' HE3' HG21 ' A' ' 57' ' ' ILE . 40.9 mtpt -145.21 167.9 21.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 71.040000000000006 110.89 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 t -138.38 126.15 28.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 71.109999999999999 111.08 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.415 ' HB2' ' CG ' ' A' ' 34' ' ' LYS . 2.7 m-85 -90.49 139.56 30.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 71.319999999999993 110.967 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -132.99 167.59 20.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 74.329999999999998 110.894 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -152.47 130.72 12.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 72.310000000000002 110.912 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.404 ' C ' ' N ' ' A' ' 46' ' ' ASP . 2.0 t -44.35 106.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 74.430000000000007 110.869 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.5 ptt85 -44.05 -23.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 73.540000000000006 110.839 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.404 ' N ' ' C ' ' A' ' 44' ' ' CYS . 2.0 m-20 -85.31 31.31 0.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 74.129999999999995 110.834 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.406 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 3.9 tm0? -82.85 -23.63 33.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 73.25 110.921 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.62 -25.84 14.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 55.219999999999999 111.081 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.36 -52.8 3.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 73.540000000000006 110.806 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.438 HD13 ' CG ' ' A' ' 71' ' ' HIS . 54.3 mt -94.39 9.43 38.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 74.400000000000006 110.91 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 46.88 32.65 6.17 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.688 -0.768 . . . . 50.299999999999997 112.537 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 36.4 t -80.7 122.23 26.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.8 0.333 . . . . 62.420000000000002 110.88 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 26.1 mmm180 -101.5 37.21 1.85 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 74.329999999999998 110.869 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.1 t -88.77 119.65 29.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 73.540000000000006 110.862 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -117.02 146.92 42.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 72.129999999999995 110.88 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.639 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -139.4 164.85 28.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 54.229999999999997 111.029 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.66 HG21 ' HE3' ' A' ' 39' ' ' LYS . 61.4 mt -132.0 117.39 33.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.245 -0.434 . . . . 75.530000000000001 111.174 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.583 HG22 HG13 ' A' ' 63' ' ' ILE . 23.7 p -102.73 144.55 30.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 73.0 111.168 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.72 109.12 3.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 71.200000000000003 110.901 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.23 -102.86 2.65 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.818 -0.706 . . . . 64.409999999999997 112.505 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.492 ' CD2' ' HA ' ' A' ' 10' ' ' PRO . 1.8 t60 -127.51 4.78 6.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.723 0.297 . . . . 73.219999999999999 110.786 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.841 ' HD3' HD12 ' A' ' 8' ' ' LEU . 19.4 mtm180 -110.68 -175.57 2.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 74.109999999999999 110.8 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.832 HD13 ' CG ' ' A' ' 25' ' ' HIS . 18.7 tt -150.21 157.27 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 73.530000000000001 111.11 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.639 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 3.2 ttp -134.83 141.57 46.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 65.329999999999998 110.838 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 19.3 t -111.91 138.44 40.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.454 . . . . 64.25 111.163 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.1 mtt -105.65 -56.84 2.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 73.329999999999998 110.887 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.459 ' HD3' ' N ' ' A' ' 68' ' ' SER . 0.0 OUTLIER -118.74 144.48 46.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 71.239999999999995 110.835 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.459 ' N ' ' HD3' ' A' ' 67' ' ' ARG . 14.2 t -69.25 -179.6 1.65 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.479 . . . . 74.299999999999997 110.898 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.447 ' N ' ' OG ' ' A' ' 68' ' ' SER . 20.5 m-70 -109.27 145.76 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 74.319999999999993 110.852 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.7 t -93.4 6.19 49.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 71.019999999999996 110.848 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.438 ' CG ' HD13 ' A' ' 50' ' ' LEU . 26.2 p80 -137.32 165.63 25.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 52.530000000000001 110.911 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -100.42 150.31 36.84 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.61 0.719 . . . . 75.239999999999995 110.913 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.497 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.5 Cg_endo -69.74 158.86 55.53 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.664 2.243 . . . . 63.310000000000002 112.292 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -139.81 90.54 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.472 . . . . 63.140000000000001 110.871 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.8 mt -55.82 -14.23 2.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.232 -0.44 . . . . 70.430000000000007 110.909 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.4 -49.06 58.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 72.209999999999994 111.07 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.99 -32.94 34.57 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.746 -0.74 . . . . 65.200000000000003 112.487 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.427 HD11 ' HE ' ' A' ' 82' ' ' ARG . 7.3 tp -67.79 -39.93 83.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 62.219999999999999 110.925 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -63.4 -24.8 68.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.134 -0.484 . . . . 73.400000000000006 110.91 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.22 70.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 74.239999999999995 111.097 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.485 HD12 HD11 ' A' ' 29' ' ' LEU . 50.3 mt -63.85 -51.67 63.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 73.230000000000004 110.909 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.907 ' HG3' HD21 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -55.72 -21.59 19.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 74.409999999999997 110.953 179.868 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.415 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 0.6 OUTLIER -78.67 -21.93 47.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.152 -0.476 . . . . 71.299999999999997 110.926 -179.914 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -81.49 -56.75 3.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 75.439999999999998 110.891 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.68 ' OE1' HD23 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -43.55 -34.15 1.32 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 64.129999999999995 110.837 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -100.47 145.03 28.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 74.310000000000002 110.823 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.7 mt . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 73.329999999999998 110.941 179.996 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 112.536 -0.226 . . . . 73.400000000000006 112.536 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.2 m -118.33 -54.83 2.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.845 0.355 . . . . 61.229999999999997 110.846 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.3 t -45.02 138.2 3.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 73.5 110.905 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.07 -170.48 46.15 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.786 -0.721 . . . . 54.409999999999997 112.456 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.7 p -100.34 109.42 21.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.904 0.383 . . . . 75.519999999999996 110.877 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.465 ' O ' ' N ' ' A' ' 8' ' ' LEU . 56.6 m -81.85 -47.19 13.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 63.340000000000003 110.817 -179.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 61.43 -75.69 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.748 -0.739 . . . . 43.210000000000001 112.481 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.465 ' N ' ' O ' ' A' ' 6' ' ' SER . 1.2 pt? -129.85 147.01 51.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.753 0.311 . . . . 72.439999999999998 110.933 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -87.94 144.25 34.47 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.61 0.719 . . . . 62.109999999999999 110.841 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.496 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 53.5 Cg_endo -69.78 -164.93 0.14 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.66 2.24 . . . . 75.120000000000005 112.381 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.597 HD22 ' HB ' ' A' ' 63' ' ' ILE . 13.5 tp -156.11 165.72 35.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.277 -0.419 . . . . 72.439999999999998 110.924 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -112.59 140.74 47.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 75.540000000000006 110.971 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.568 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 70.3 m-85 -139.84 172.91 12.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 61.539999999999999 110.887 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.672 HD12 ' CG2' ' A' ' 24' ' ' VAL . 6.3 mt -151.78 162.5 40.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.132 -0.486 . . . . 75.430000000000007 110.841 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -127.95 149.84 50.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 73.430000000000007 110.842 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.432 ' O ' ' C ' ' A' ' 17' ' ' SER . 2.9 p -106.87 156.18 18.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.45 . . . . 64.209999999999994 111.155 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 16' ' ' THR . 5.6 m -35.75 -61.42 0.47 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 62.229999999999997 110.876 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.64 ' N ' HD13 ' A' ' 18' ' ' LEU . 0.1 OUTLIER -84.63 -175.06 5.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.077 -0.51 . . . . 71.319999999999993 110.889 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -58.98 78.84 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.699 -0.762 . . . . 50.439999999999998 112.525 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.48 ' N ' ' O ' ' A' ' 18' ' ' LEU . . . -150.3 148.96 20.73 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.74 -0.743 . . . . 74.409999999999997 112.449 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.436 ' NE ' ' O ' ' A' ' 14' ' ' LEU . 5.9 tpt180 -140.94 129.12 22.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.85 0.357 . . . . 71.420000000000002 110.88 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -105.43 160.53 15.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 72.530000000000001 110.925 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.566 HD13 ' CE1' ' A' ' 13' ' ' PHE . 20.3 tp -119.66 125.27 48.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 71.510000000000005 110.936 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.672 ' CG2' HD12 ' A' ' 14' ' ' LEU . 20.9 t -106.15 123.0 60.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 65.230000000000004 111.162 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.788 ' CG ' HD13 ' A' ' 63' ' ' ILE . 64.9 t60 -153.02 138.77 17.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.138 -0.483 . . . . 75.329999999999998 110.877 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 54.82 24.68 5.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 74.340000000000003 110.878 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m 75.24 26.63 1.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.487 . . . . 44.509999999999998 110.903 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -124.94 -176.07 3.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 74.319999999999993 110.899 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.645 HD13 ' NE ' ' A' ' 45' ' ' ARG . 56.0 mt -128.98 147.56 50.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 65.439999999999998 110.888 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.602 ' CD1' ' C ' ' A' ' 29' ' ' LEU . 1.0 OUTLIER -144.77 173.75 11.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 65.209999999999994 110.915 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -135.59 141.91 45.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.126 -0.488 . . . . 72.310000000000002 110.887 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.2 tttm -64.35 115.51 5.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 73.239999999999995 110.882 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -92.91 -57.18 2.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 71.340000000000003 110.926 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -150.6 179.04 8.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.487 . . . . 53.109999999999999 110.951 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -136.88 117.73 14.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 54.020000000000003 111.177 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.57 -175.57 3.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 62.039999999999999 111.04 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -48.97 94.36 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.72 -0.752 . . . . 71.239999999999995 112.494 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 62.51 34.59 15.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.934 0.397 . . . . 73.230000000000004 110.887 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -145.33 158.03 43.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 74.129999999999995 110.885 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.1 t -138.25 114.17 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 62.409999999999997 111.114 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -78.69 146.07 34.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 74.319999999999993 110.914 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.545 ' CD2' HD22 ' A' ' 23' ' ' LEU . 69.5 m95 -135.88 151.85 50.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.079 -0.509 . . . . 62.310000000000002 110.905 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -134.93 129.82 34.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 65.230000000000004 110.895 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.6 t -42.81 116.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 74.450000000000003 110.859 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.645 ' NE ' HD13 ' A' ' 29' ' ' LEU . 18.3 ptt180 -55.14 -20.55 10.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 60.32 110.874 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.54 36.44 0.54 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 65.0 110.854 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -88.43 -18.88 27.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.143 -0.48 . . . . 74.519999999999996 110.913 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.12 -31.05 12.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 64.010000000000005 111.144 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.0 ttm-85 -95.05 -57.36 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 71.230000000000004 110.811 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.475 ' O ' ' N ' ' A' ' 52' ' ' CYS . 22.6 mt -95.61 22.65 6.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 63.200000000000003 110.915 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.94 29.66 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.687 -0.768 . . . . 73.230000000000004 112.466 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.475 ' N ' ' O ' ' A' ' 50' ' ' LEU . 4.7 t -75.76 127.66 33.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.844 0.354 . . . . 74.209999999999994 110.852 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.33 -10.92 17.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 74.319999999999993 110.844 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 m -39.32 128.26 1.8 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.229 -0.441 . . . . 51.32 110.86 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.401 ' C ' ' HG3' ' A' ' 66' ' ' MET . 16.0 mtt85 -123.82 166.03 16.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 74.420000000000002 110.842 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.476 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -149.72 156.51 41.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 75.049999999999997 111.075 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 91.0 mt -125.42 122.49 62.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 71.109999999999999 111.121 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.675 HG22 HG13 ' A' ' 63' ' ' ILE . 34.3 p -101.1 142.43 32.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 74.319999999999993 111.128 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.95 87.17 2.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 73.129999999999995 110.95 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.45 -85.23 1.56 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.721 -0.752 . . . . 71.129999999999995 112.486 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.496 ' CG ' ' HA ' ' A' ' 10' ' ' PRO . 0.4 OUTLIER -128.89 -1.24 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.771 0.32 . . . . 63.310000000000002 110.855 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.444 ' CZ ' ' HB3' ' A' ' 62' ' ' ARG . 1.4 mtp-105 -102.71 174.39 5.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 62.32 110.888 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.788 HD13 ' CG ' ' A' ' 25' ' ' HIS . 4.9 tt -145.06 154.14 14.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 72.010000000000005 111.114 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.476 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 9.4 ttp -138.16 142.66 40.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.149 -0.478 . . . . 75.420000000000002 110.882 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.1 t -95.14 145.03 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 74.329999999999998 111.067 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.401 ' HG3' ' C ' ' A' ' 55' ' ' ARG . 31.0 mtp -104.77 -61.04 1.51 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.088 -0.505 . . . . 74.310000000000002 110.783 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -123.02 162.65 21.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 70.230000000000004 110.888 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.34 153.91 29.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 43.399999999999999 110.86 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -92.37 137.86 32.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.099 -0.5 . . . . 75.040000000000006 110.848 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 51.9 t -89.48 10.1 24.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 72.25 110.865 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.44 ' CB ' HD13 ' A' ' 50' ' ' LEU . 31.8 p80 -136.93 142.81 42.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 73.5 110.801 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -79.8 155.59 75.49 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.587 0.708 . . . . 74.230000000000004 110.914 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.66 155.86 65.14 Favored 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.743 2.295 . . . . 70.109999999999999 112.365 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -133.14 80.37 1.88 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 70.409999999999997 110.884 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.514 HD23 ' N ' ' A' ' 75' ' ' LEU . 3.4 mt -45.78 -23.85 0.31 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.234 -0.439 . . . . 74.120000000000005 110.848 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.57 -43.18 73.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 54.310000000000002 111.088 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -77.99 -36.8 30.94 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.753 -0.737 . . . . 70.030000000000001 112.465 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tp -69.64 -37.39 76.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.741 0.305 . . . . 75.209999999999994 110.94 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -68.98 -29.44 67.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 74.140000000000001 110.904 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.63 93.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.1 -0.5 . . . . 64.120000000000005 111.102 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 61.4 mt -67.98 -46.96 69.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.23 -0.441 . . . . 65.150000000000006 110.966 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.8 mtp-105 -65.95 -20.73 66.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.791 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.44 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -75.08 -29.27 60.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 74.430000000000007 110.963 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 23.4 mtp85 -77.98 -28.23 49.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 73.129999999999995 110.874 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -62.63 -59.09 5.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 75.140000000000001 110.861 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 -108.15 90.45 3.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 62.109999999999999 110.828 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.54 ' C ' HD12 ' A' ' 87' ' ' LEU . 4.4 pp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 74.239999999999995 110.843 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.463 ' O ' ' N ' ' A' ' 3' ' ' SER . . . . . . . . 0 N--CA 1.452 -0.288 0 N-CA-C 112.47 -0.252 . . . . 74.409999999999997 112.47 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 1' ' ' GLY . 1.4 m 34.52 34.28 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.877 0.37 . . . . 73.310000000000002 110.884 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.463 ' N ' ' O ' ' A' ' 1' ' ' GLY . 1.9 m -61.94 -24.99 67.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.088 -0.506 . . . . 72.329999999999998 110.797 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.49 -157.63 33.87 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.766 -0.731 . . . . 54.299999999999997 112.504 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 28.5 t -155.38 127.76 7.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.822 0.344 . . . . 51.020000000000003 110.84 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.6 t -112.41 4.12 17.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 75.329999999999998 110.877 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.43 1.78 4.67 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.81 -0.71 . . . . 61.210000000000001 112.495 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.813 ' C ' HD12 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -106.54 96.24 6.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.817 0.342 . . . . 64.209999999999994 110.88 -179.888 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.479 ' N ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -77.78 143.92 67.87 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.571 0.7 . . . . 71.140000000000001 110.924 179.911 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.487 ' CB ' ' CE1' ' A' ' 61' ' ' HIS . 53.5 Cg_endo -69.76 -176.36 1.46 Allowed 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 122.649 2.232 . . . . 72.450000000000003 112.401 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.615 HD21 HD11 ' A' ' 23' ' ' LEU . 28.8 tp -135.93 143.28 44.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.299 -0.409 . . . . 73.230000000000004 110.951 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.464 ' OE1' HG11 ' A' ' 24' ' ' VAL . 41.3 tt0 -98.15 147.47 24.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.463 . . . . 73.200000000000003 110.858 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.537 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 52.3 m-85 -136.68 172.86 12.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 63.049999999999997 110.874 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.507 HD12 ' CG2' ' A' ' 24' ' ' VAL . 5.0 mt -147.51 158.29 43.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 72.450000000000003 110.923 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 -124.46 128.01 48.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 73.120000000000005 110.876 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.435 HG21 ' CE1' ' A' ' 22' ' ' PHE . 11.2 p -94.46 143.7 26.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.11 -0.496 . . . . 73.540000000000006 111.209 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 58.1 m -58.31 -21.16 48.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 60.32 110.956 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -80.65 42.5 0.62 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.05 -0.523 . . . . 53.439999999999998 110.919 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 48.3 19.38 1.13 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.785 -0.722 . . . . 33.229999999999997 112.483 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -106.75 166.01 13.52 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.766 -0.73 . . . . 72.510000000000005 112.448 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.6 ttt85 -123.9 124.27 42.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.851 0.358 . . . . 74.439999999999998 110.915 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.556 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -100.99 170.73 8.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 73.0 110.855 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.615 HD11 HD21 ' A' ' 11' ' ' LEU . 4.3 tp -139.1 138.17 36.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 72.310000000000002 110.93 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.507 ' CG2' HD12 ' A' ' 14' ' ' LEU . 18.1 t -104.26 126.55 58.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 71.420000000000002 111.093 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.771 ' CG ' HD13 ' A' ' 63' ' ' ILE . 5.2 t60 -159.73 132.28 6.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.128 -0.487 . . . . 72.230000000000004 110.844 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 53.17 37.79 25.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 64.409999999999997 110.9 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 72.1 m 63.05 26.7 15.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 65.010000000000005 110.857 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -126.68 164.11 22.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 73.530000000000001 110.807 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.552 HD12 ' CZ ' ' A' ' 45' ' ' ARG . 62.6 mt -115.3 137.64 51.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 72.219999999999999 110.867 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.536 ' CE1' ' HB3' ' A' ' 25' ' ' HIS . 1.6 m-85 -127.16 168.02 15.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 71.409999999999997 110.995 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.556 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 12.4 mtp-105 -128.72 118.38 22.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 72.040000000000006 110.893 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.446 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 32.8 tttm -41.57 116.6 0.79 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.444 . . . . 70.239999999999995 110.836 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -91.5 -54.34 3.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.219 -0.446 . . . . 73.109999999999999 110.906 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.91 -178.19 6.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 74.239999999999995 110.894 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.89 135.19 20.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 60.119999999999997 111.13 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -104.81 36.49 2.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 53.32 111.076 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.25 -63.27 4.45 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.722 -0.751 . . . . 74.239999999999995 112.43 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -101.75 -26.87 13.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.964 0.411 . . . . 63.200000000000003 110.866 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.9 mtmp? -105.4 159.91 15.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.483 . . . . 75.310000000000002 110.86 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.4 t -137.57 116.75 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 74.439999999999998 111.179 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.557 ' CE2' HD11 ' A' ' 57' ' ' ILE . 3.4 m-85 -80.75 145.9 31.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 63.039999999999999 110.954 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.542 ' CD1' HG23 ' A' ' 58' ' ' THR . 77.1 m95 -137.29 148.7 46.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 71.030000000000001 110.874 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 12.2 ptt? -131.62 126.88 35.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 63.530000000000001 110.843 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -42.54 120.78 1.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 74.310000000000002 110.85 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.552 ' CZ ' HD12 ' A' ' 29' ' ' LEU . 19.8 ptt180 -53.02 -17.84 1.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 63.25 110.884 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.564 ' HB3' HD12 ' A' ' 50' ' ' LEU . 1.1 m-20 -87.88 17.45 4.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 73.439999999999998 110.903 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.41 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -78.49 -15.5 58.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.227 -0.442 . . . . 61.219999999999999 110.888 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.403 ' HB2' ' OE1' ' A' ' 47' ' ' GLN . . . -96.76 -32.85 11.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 63.439999999999998 111.05 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -98.38 -62.51 1.23 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 74.010000000000005 110.843 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.564 HD12 ' HB3' ' A' ' 46' ' ' ASP . 31.6 mt -83.12 15.45 2.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 52.109999999999999 110.922 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.61 33.54 1.55 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.789 -0.72 . . . . 71.510000000000005 112.429 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.405 ' N ' ' HA ' ' A' ' 47' ' ' GLN . 38.1 t -77.75 108.91 11.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.8 0.333 . . . . 75.140000000000001 110.92 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -84.35 12.56 6.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 74.310000000000002 110.856 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.1 t -60.22 113.41 2.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 75.450000000000003 110.874 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.6 mtm180 -119.34 137.94 53.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 75.540000000000006 110.867 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.64 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -126.6 160.43 30.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 74.420000000000002 111.132 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.557 HD11 ' CE2' ' A' ' 41' ' ' TYR . 31.6 mt -128.23 128.36 68.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 74.099999999999994 111.158 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.542 HG23 ' CD1' ' A' ' 42' ' ' TRP . 19.3 p -101.95 147.39 26.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 74.120000000000005 111.205 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -142.83 106.89 4.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 72.430000000000007 110.875 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 69.93 -92.86 0.39 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.744 -0.741 . . . . 75.010000000000005 112.51 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.487 ' CE1' ' CB ' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -128.82 6.91 5.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.772 0.32 . . . . 75.099999999999994 110.887 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.672 ' CG ' HD13 ' A' ' 8' ' ' LEU . 39.4 mtp85 -108.03 -175.93 2.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.287 -0.415 . . . . 74.120000000000005 110.867 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.771 HD13 ' CG ' ' A' ' 25' ' ' HIS . 9.8 tt -150.35 153.41 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 74.310000000000002 111.104 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.64 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 68.2 mtm -135.92 146.88 47.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 71.400000000000006 110.832 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.2 t -116.51 132.23 66.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 70.439999999999998 111.13 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mmm -92.02 -58.55 2.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 55.100000000000001 110.891 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -118.44 160.19 22.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 74.040000000000006 110.861 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.2 m -78.62 -179.71 6.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 61.100000000000001 110.76 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -108.26 139.83 42.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.105 -0.498 . . . . 60.420000000000002 110.814 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.1 t -94.52 15.91 16.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 54.140000000000001 110.922 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.458 ' CB ' HD13 ' A' ' 50' ' ' LEU . 24.3 p80 -145.25 150.89 37.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.144 -0.48 . . . . 71.530000000000001 110.826 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -81.07 152.43 71.32 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.579 0.704 . . . . 62.210000000000001 110.964 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 149.61 67.36 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.708 2.272 . . . . 73.109999999999999 112.372 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.33 81.42 1.89 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.271 -0.422 . . . . 51.210000000000001 110.837 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 34.7 mt -53.95 -23.48 13.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 73.519999999999996 110.971 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.0 -45.71 66.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 55.020000000000003 111.147 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.01 -31.38 43.41 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.728 -0.749 . . . . 53.210000000000001 112.519 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tp -70.68 -38.3 73.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.723 0.297 . . . . 71.549999999999997 110.911 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -68.55 -23.46 64.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.254 -0.43 . . . . 74.439999999999998 110.849 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.55 -44.57 86.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 41.399999999999999 111.077 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.2 mt -69.92 -50.35 42.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 75.209999999999994 110.885 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.433 ' HG3' HD11 ' A' ' 14' ' ' LEU . 50.3 mtp180 -60.25 -19.61 55.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 71.239999999999995 110.879 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.411 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 0.5 OUTLIER -76.76 -24.39 52.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 72.209999999999994 110.909 -179.905 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 85' ' ' GLU . 29.0 mtt180 -85.81 -35.05 20.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 75.120000000000005 110.822 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.405 ' C ' ' O ' ' A' ' 84' ' ' ARG . 1.0 OUTLIER -37.77 -44.42 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 61.439999999999998 110.924 -179.889 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.25 139.9 38.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 71.109999999999999 110.871 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.6 tp . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 73.439999999999998 110.921 179.966 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.374 0 N-CA-C 112.487 -0.245 . . . . 44.119999999999997 112.487 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.4 t -145.6 152.84 40.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.921 0.391 . . . . 74.299999999999997 110.876 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.6 t -71.6 98.85 1.96 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.14 -0.482 . . . . 74.430000000000007 110.861 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.74 157.18 15.46 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.741 -0.742 . . . . 55.109999999999999 112.454 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 41.3 t -104.4 13.41 32.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.88 0.371 . . . . 71.030000000000001 110.885 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 28.4 m -85.57 -32.06 22.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 64.400000000000006 110.924 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.53 -84.96 0.38 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.794 -0.717 . . . . 63.310000000000002 112.53 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.975 HD12 ' HG3' ' A' ' 62' ' ' ARG . 0.5 OUTLIER -172.19 176.73 3.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.812 0.339 . . . . 70.540000000000006 110.921 -179.912 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.8 mtt85 -111.53 144.0 29.66 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.638 0.733 . . . . 64.439999999999998 110.894 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.4 ' HB3' ' NE2' ' A' ' 61' ' ' HIS . 53.5 Cg_endo -69.76 177.68 5.33 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.663 2.242 . . . . 72.329999999999998 112.304 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.725 HD21 HD11 ' A' ' 23' ' ' LEU . 24.5 tp -145.45 145.02 30.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 70.310000000000002 110.968 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 -101.24 152.87 20.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.212 -0.449 . . . . 61.109999999999999 110.942 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.696 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 61.6 m-85 -137.93 169.93 16.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.109999999999999 110.832 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.623 HD12 ' CG2' ' A' ' 24' ' ' VAL . 4.1 mt -145.08 165.21 28.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 53.340000000000003 110.956 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -127.8 147.85 50.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 71.329999999999998 110.899 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.443 ' OG1' ' N ' ' A' ' 20' ' ' GLY . 1.2 p -115.08 169.91 8.75 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.118 -0.492 . . . . 65.099999999999994 111.089 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 67.0 m -95.64 -51.26 4.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 73.319999999999993 110.846 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.3 mp -84.97 -44.75 12.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 62.310000000000002 110.911 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.5 -105.25 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.79 -0.719 . . . . 73.129999999999995 112.46 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.443 ' N ' ' OG1' ' A' ' 16' ' ' THR . . . -165.02 -92.15 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.779 -0.724 . . . . 31.02 112.489 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.5 tpt85 -130.64 129.31 42.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.831 0.348 . . . . 63.439999999999998 110.813 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.471 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -103.55 165.54 10.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 64.25 110.878 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.725 HD11 HD21 ' A' ' 11' ' ' LEU . 8.4 tp -130.4 135.13 47.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 53.200000000000003 110.946 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 1.022 HG11 ' NH2' ' A' ' 82' ' ' ARG . 68.0 t -101.85 116.92 46.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 73.329999999999998 111.072 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.643 ' CG ' HD13 ' A' ' 63' ' ' ILE . 10.7 t60 -152.83 127.03 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 70.209999999999994 110.874 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 59.89 43.43 14.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 72.200000000000003 110.867 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.438 ' OG ' ' CD2' ' A' ' 75' ' ' LEU . 1.4 t 56.89 20.11 5.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.122 -0.49 . . . . 74.019999999999996 110.88 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.411 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 20.1 m-85 -116.52 -177.38 3.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 74.209999999999994 110.928 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.45 HD12 ' HE ' ' A' ' 45' ' ' ARG . 65.8 mt -134.14 134.08 41.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 74.310000000000002 110.897 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.511 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -125.93 172.03 10.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 75.310000000000002 110.956 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.471 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 59.4 mtp180 -131.7 129.08 40.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 73.540000000000006 110.924 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.43 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 51.6 tttm -54.86 122.07 9.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 62.520000000000003 110.934 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -94.06 -54.81 3.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 64.349999999999994 110.903 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.05 164.57 37.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.5 . . . . 75.120000000000005 110.846 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.48 131.98 54.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.439 . . . . 72.450000000000003 111.096 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -101.97 37.13 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.288 -0.414 . . . . 74.319999999999993 111.12 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.98 -73.39 2.31 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.682 -0.771 . . . . 62.009999999999998 112.453 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -102.95 -11.28 18.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 72.430000000000007 110.9 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 27.5 mtmm -115.38 156.57 25.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 73.409999999999997 110.897 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.0 t -133.79 114.42 19.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 74.439999999999998 111.144 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -77.74 149.06 34.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 72.200000000000003 110.967 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.481 ' CD1' HG23 ' A' ' 58' ' ' THR . 77.2 m95 -139.84 165.21 27.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 75.519999999999996 110.952 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 19.4 ptt? -151.45 133.58 15.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 72.120000000000005 110.845 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.7 t -46.22 118.17 1.82 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 75.150000000000006 110.88 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.45 ' HE ' HD12 ' A' ' 29' ' ' LEU . 41.6 ptt85 -52.06 -23.89 5.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 73.310000000000002 110.878 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -81.98 12.34 4.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 71.430000000000007 110.788 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.415 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 5.3 tm0? -71.46 -17.45 62.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.184 -0.462 . . . . 75.150000000000006 110.931 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.15 -36.76 11.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 74.239999999999995 111.109 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.3 mtt85 -93.54 -62.75 1.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 71.340000000000003 110.886 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.417 ' O ' ' C ' ' A' ' 51' ' ' GLY . 39.7 mt -84.25 18.32 2.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.469 . . . . 64.209999999999994 110.849 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.48 38.63 0.29 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.771 -0.728 . . . . 71.209999999999994 112.497 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 32.7 t -78.2 102.32 7.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.819 0.342 . . . . 72.310000000000002 110.865 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -81.91 45.61 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 63.329999999999998 110.913 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.8 t -100.04 111.7 23.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 71.040000000000006 110.921 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -107.17 161.07 15.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 73.219999999999999 110.921 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.641 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -149.86 162.6 39.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.257 -0.428 . . . . 55.240000000000002 111.116 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 74.6 mt -134.26 125.34 47.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 74.219999999999999 111.151 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.481 HG23 ' CD1' ' A' ' 42' ' ' TRP . 32.2 p -101.58 150.84 22.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.451 . . . . 73.209999999999994 111.15 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -147.71 112.97 5.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 71.129999999999995 110.954 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 65.25 -92.75 0.15 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.796 -0.716 . . . . 71.439999999999998 112.558 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.462 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -128.94 2.49 5.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.811 0.338 . . . . 75.200000000000003 110.883 -179.979 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.975 ' HG3' HD12 ' A' ' 8' ' ' LEU . 17.1 mtt85 -102.33 -175.31 2.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 73.420000000000002 110.796 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.643 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -151.0 156.35 6.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 72.519999999999996 111.118 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.641 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 49.3 mtm -136.49 149.05 47.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.451 . . . . 74.319999999999993 110.894 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.5 t -121.55 133.89 66.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 63.210000000000001 111.121 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.4 mtp -93.56 -63.43 1.2 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.14 -0.482 . . . . 61.329999999999998 110.834 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -112.82 167.95 10.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 71.450000000000003 110.854 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.5 m -84.99 -177.55 6.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 74.120000000000005 110.883 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -110.04 137.87 47.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 71.099999999999994 110.903 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.6 t -91.79 13.96 16.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 71.239999999999995 110.872 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 24.0 p80 -143.8 159.33 42.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 73.030000000000001 110.825 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.9 mm100 -90.83 153.87 45.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.609 0.719 . . . . 73.430000000000007 110.891 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.411 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.3 Cg_endo -69.83 139.46 40.04 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.716 2.277 . . . . 73.420000000000002 112.289 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 77' ' ' GLY . 13.1 t0 -101.27 79.35 1.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 74.049999999999997 110.874 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.438 ' CD2' ' OG ' ' A' ' 27' ' ' SER . 7.9 mt -46.88 -24.64 0.62 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 73.109999999999999 110.935 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.66 -26.29 19.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 73.340000000000003 111.124 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 74' ' ' ASP . . . -84.07 -46.62 5.84 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.738 -0.744 . . . . 74.049999999999997 112.496 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.4 tp -67.71 -35.63 79.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 73.329999999999998 110.914 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -72.26 -31.44 65.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.161 -0.472 . . . . 62.340000000000003 110.952 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.72 -44.88 95.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 55.25 111.123 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.6 mt -60.18 -41.38 92.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 70.299999999999997 110.978 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 1.022 ' NH2' HG11 ' A' ' 24' ' ' VAL . 10.7 mtt180 -74.07 -15.29 61.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.145 -0.48 . . . . 70.450000000000003 110.901 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -80.61 -48.71 12.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 71.140000000000001 110.944 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' A' ' 85' ' ' GLU . 3.2 ptm180 -69.48 -33.14 72.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 73.530000000000001 110.95 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.419 ' C ' ' O ' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -36.65 -50.84 0.84 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 72.040000000000006 110.887 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.7 mtp180 -102.68 162.52 12.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 74.239999999999995 110.904 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.523 HD23 ' H ' ' A' ' 87' ' ' LEU . 1.7 pt? . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 63.149999999999999 110.924 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 112.493 -0.243 . . . . 42.109999999999999 112.493 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.7 p -53.09 156.38 2.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.864 0.364 . . . . 52.149999999999999 110.789 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.3 p -163.42 150.37 12.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 71.450000000000003 110.827 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.06 99.41 0.17 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.726 -0.75 . . . . 32.549999999999997 112.474 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.2 m -108.92 166.79 10.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.906 0.384 . . . . 65.109999999999999 110.803 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 6.5 t -87.3 7.27 29.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.072 -0.513 . . . . 74.409999999999997 110.867 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.95 39.5 1.95 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.697 -0.764 . . . . 70.420000000000002 112.535 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.664 HD13 ' HD2' ' A' ' 62' ' ' ARG . 0.9 OUTLIER -160.97 108.41 1.51 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.884 0.373 . . . . 74.109999999999999 110.911 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.589 ' N ' HD12 ' A' ' 8' ' ' LEU . 7.3 mpt_? -104.77 143.99 27.82 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.627 0.727 . . . . 71.329999999999998 110.846 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.475 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 53.7 Cg_endo -69.73 -174.77 0.96 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 60.229999999999997 112.298 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.975 HD21 HD11 ' A' ' 23' ' ' LEU . 20.4 tp -140.44 150.85 44.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 71.319999999999993 110.944 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -105.31 148.28 27.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 71.540000000000006 110.88 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -139.81 172.86 12.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.128 -0.487 . . . . 74.239999999999995 110.863 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.765 HD21 ' HG2' ' A' ' 82' ' ' ARG . 6.3 mt -150.65 118.51 6.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.138 -0.483 . . . . 64.140000000000001 110.926 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.5 mtp180 -98.72 138.24 36.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.040000000000006 110.832 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.455 HG23 ' O ' ' A' ' 20' ' ' GLY . 1.2 p -114.76 164.3 14.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.462 . . . . 75.439999999999998 111.129 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.7 m -106.85 -24.1 12.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 62.130000000000003 110.88 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.5 mp -98.71 5.85 47.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.109 -0.496 . . . . 64.150000000000006 110.92 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.16 -109.37 0.47 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.8 -0.714 . . . . 75.230000000000004 112.524 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.455 ' O ' HG23 ' A' ' 16' ' ' THR . . . -149.49 -152.79 5.84 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.74 -0.743 . . . . 74.140000000000001 112.453 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.46 ' HD3' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -88.25 148.88 24.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.895 0.379 . . . . 74.409999999999997 110.825 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.46 ' N ' ' HD3' ' A' ' 21' ' ' ARG . 2.6 m-85 -126.32 157.48 38.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 73.540000000000006 110.9 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.975 HD11 HD21 ' A' ' 11' ' ' LEU . 15.7 tp -120.58 116.47 25.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.152 -0.476 . . . . 71.049999999999997 110.979 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.585 ' CG2' HD12 ' A' ' 14' ' ' LEU . 58.8 t -90.88 114.52 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 62.32 111.074 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.8 ' CG ' HD13 ' A' ' 63' ' ' ILE . 6.9 t60 -151.6 127.13 10.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.138 -0.483 . . . . 63.229999999999997 110.868 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 62.97 38.51 11.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 72.120000000000005 110.897 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 m 60.03 29.19 18.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.091 -0.504 . . . . 74.439999999999998 110.855 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -130.48 178.15 6.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 51.399999999999999 110.882 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.421 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 32.1 mt -130.43 132.76 45.88 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.093 -0.503 . . . . 65.530000000000001 110.883 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.523 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -127.28 167.53 16.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 52.420000000000002 110.907 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.2 mtp180 -126.96 138.92 53.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.119 -0.492 . . . . 74.420000000000002 110.856 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 25.2 tttm -59.51 116.76 4.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 75.099999999999994 110.884 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -91.63 -52.93 4.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 73.420000000000002 110.86 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.64 ' NZ ' ' CD2' ' A' ' 41' ' ' TYR . 1.8 pttm -160.53 177.84 10.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 74.219999999999999 110.862 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.33 120.02 14.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 52.43 111.026 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.27 38.16 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.481 . . . . 54.020000000000003 111.082 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 102.73 -89.13 0.7 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.728 -0.749 . . . . 51.219999999999999 112.468 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -96.72 -4.43 40.74 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.825 0.345 . . . . 72.140000000000001 110.823 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.419 ' HB2' ' HZ2' ' A' ' 39' ' ' LYS . 5.9 mtmp? -113.7 158.61 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 73.530000000000001 110.855 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 t -136.26 119.24 22.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 72.129999999999995 111.107 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.64 ' CD2' ' NZ ' ' A' ' 34' ' ' LYS . 3.3 m-85 -81.31 151.19 28.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 61.409999999999997 110.941 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.676 ' CD1' HG23 ' A' ' 58' ' ' THR . 75.4 m95 -141.49 146.32 36.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 73.530000000000001 110.912 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.7 ptt? -129.26 144.56 51.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 72.340000000000003 110.871 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -55.13 108.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.432 . . . . 70.230000000000004 110.887 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.421 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.9 ptt-85 -39.98 -30.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 74.329999999999998 110.9 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -77.88 51.91 0.99 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 71.109999999999999 110.849 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -75.49 -51.8 12.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.252 -0.431 . . . . 62.130000000000003 110.909 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -98.0 -13.9 20.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 64.219999999999999 111.064 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 mmt-85 -81.82 -61.15 2.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 74.109999999999999 110.906 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.3 mt -108.01 26.75 9.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 74.219999999999999 110.928 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 38.4 42.45 1.31 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.789 -0.72 . . . . 75.349999999999994 112.469 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.7 t -96.32 130.01 43.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.79 0.328 . . . . 74.340000000000003 110.88 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -111.83 17.78 19.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.474 . . . . 71.420000000000002 110.841 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.9 t -69.51 127.88 34.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 72.030000000000001 110.832 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -121.62 173.15 7.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 72.010000000000005 110.899 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.744 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -155.52 163.76 39.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.466 . . . . 60.32 111.108 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 97.7 mt -128.37 121.71 56.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 64.439999999999998 111.089 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.676 HG23 ' CD1' ' A' ' 42' ' ' TRP . 20.1 p -101.08 151.27 22.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 73.450000000000003 111.151 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.18 113.14 2.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.465 . . . . 72.129999999999995 110.866 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 73.48 -101.11 1.13 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.793 -0.718 . . . . 73.510000000000005 112.486 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.579 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -127.06 7.12 6.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.736 0.303 . . . . 75.230000000000004 110.861 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.664 ' HD2' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -111.06 -175.42 2.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 70.140000000000001 110.868 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.8 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.89 162.72 3.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 73.209999999999994 111.102 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.744 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 1.5 ttp -143.5 148.84 36.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 75.120000000000005 110.889 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.6 t -113.64 144.38 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.426 . . . . 71.200000000000003 111.093 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 14.3 mtp -104.67 -61.61 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 72.230000000000004 110.895 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 52.9 mtt-85 -111.44 170.73 7.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 73.409999999999997 110.892 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 80.6 p -88.88 -177.91 5.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 75.310000000000002 110.858 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -116.01 138.96 50.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.067 -0.515 . . . . 74.299999999999997 110.866 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 4.3 t -90.98 8.35 35.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 71.319999999999993 110.837 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 26.5 p80 -135.59 157.76 46.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 63.32 110.792 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -91.62 151.79 42.76 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.568 0.699 . . . . 62.439999999999998 110.878 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 150.24 67.73 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.682 2.255 . . . . 75.209999999999994 112.347 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.56 81.37 1.97 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.231 -0.44 . . . . 72.230000000000004 110.913 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.443 HD23 ' N ' ' A' ' 75' ' ' LEU . 6.0 mt -48.25 -28.28 2.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 70.510000000000005 110.96 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.64 77.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 71.519999999999996 111.143 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.98 -29.23 59.25 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.741 -0.742 . . . . 72.519999999999996 112.516 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.1 tp -76.72 -41.09 46.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.761 0.315 . . . . 54.240000000000002 110.914 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -75.52 -23.43 56.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 71.209999999999994 110.908 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.92 -18.4 47.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 63.039999999999999 111.067 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.0 mt -80.56 -41.48 24.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 73.5 110.884 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.765 ' HG2' HD21 ' A' ' 14' ' ' LEU . 14.8 mtm180 -56.47 -49.15 75.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 75.209999999999994 110.854 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.439 ' HG3' ' N ' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -51.56 -35.46 41.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 71.540000000000006 110.88 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.439 ' N ' ' HG3' ' A' ' 83' ' ' GLN . 8.8 mtt-85 -72.81 -20.73 61.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 64.430000000000007 110.834 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.448 ' O ' ' CD ' ' A' ' 85' ' ' GLU . 2.2 tp10 -102.11 -14.62 17.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 74.329999999999998 110.868 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -106.45 138.92 41.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 64.239999999999995 110.812 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.628 HD23 ' H ' ' A' ' 87' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 74.519999999999996 110.927 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 112.521 -0.232 . . . . 71.540000000000006 112.521 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 m -135.45 155.51 50.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.847 0.356 . . . . 73.219999999999999 110.93 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 25.4 t -120.66 -30.54 4.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 70.150000000000006 110.877 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.1 135.03 4.38 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.701 -0.762 . . . . 75.439999999999998 112.473 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.4 p -79.5 -63.59 1.38 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.882 0.372 . . . . 70.140000000000001 110.875 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 92.8 p -108.03 87.74 2.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 74.450000000000003 110.822 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 8' ' ' LEU . . . -62.92 -31.42 80.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 72.340000000000003 112.509 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.638 HD11 ' HB3' ' A' ' 61' ' ' HIS . 8.0 tp -35.08 96.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.836 0.351 . . . . 70.430000000000007 110.894 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.432 ' N ' ' O ' ' A' ' 7' ' ' GLY . 3.8 mmp_? -92.11 144.0 28.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.611 0.72 . . . . 75.109999999999999 110.907 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.46 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 54.1 Cg_endo -69.71 173.51 10.82 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.703 2.269 . . . . 74.129999999999995 112.3 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 1.032 HD21 HD11 ' A' ' 23' ' ' LEU . 31.5 tp -133.22 144.46 49.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 74.439999999999998 110.925 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -98.65 159.9 14.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 71.230000000000004 110.853 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -139.31 171.9 13.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.475 . . . . 63.130000000000003 110.861 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.607 HD21 ' HG2' ' A' ' 82' ' ' ARG . 11.4 mt -148.16 128.14 13.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.126 -0.488 . . . . 74.209999999999994 110.967 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.1 mtp-105 -114.28 131.91 56.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 74.319999999999993 110.875 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.3 p -101.16 167.9 9.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 73.400000000000006 111.119 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 32.4 t -90.0 -4.22 57.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 72.030000000000001 110.821 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.429 HD23 ' N ' ' A' ' 18' ' ' LEU . 5.6 mt -86.13 11.93 10.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 72.230000000000004 110.918 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.24 34.72 40.2 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.799 -0.715 . . . . 75.109999999999999 112.437 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -136.5 155.33 22.5 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.726 -0.75 . . . . 32.130000000000003 112.441 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.0 ttm180 -108.53 164.33 12.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.86 0.362 . . . . 72.420000000000002 110.899 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.491 ' N ' ' O ' ' A' ' 14' ' ' LEU . 3.0 m-85 -143.76 158.52 43.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 75.340000000000003 110.842 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 1.032 HD11 HD21 ' A' ' 11' ' ' LEU . 12.8 tp -126.46 115.85 20.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 75.109999999999999 110.903 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.582 HG22 HD12 ' A' ' 14' ' ' LEU . 59.4 t -89.56 122.79 41.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 73.329999999999998 111.111 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.902 ' CG ' HD13 ' A' ' 63' ' ' ILE . 33.7 t60 -161.3 134.04 6.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 64.239999999999995 110.907 179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.498 ' HG2' ' CE1' ' A' ' 25' ' ' HIS . 40.4 mm-40 60.19 29.7 19.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 72.239999999999995 110.905 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.7 m 65.74 27.71 11.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 74.420000000000002 110.845 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.535 ' CE2' ' CD2' ' A' ' 69' ' ' HIS . 16.6 m-85 -126.07 -174.26 3.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 72.140000000000001 110.963 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.445 HD21 HD12 ' A' ' 14' ' ' LEU . 40.7 mt -135.31 130.9 35.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.219999999999999 110.898 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.468 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 2.0 m-85 -127.42 159.42 34.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.137 -0.483 . . . . 72.540000000000006 110.922 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.474 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 3.7 mtt-85 -116.33 148.8 40.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.103 -0.499 . . . . 74.140000000000001 110.873 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 41.3 tttp -71.13 109.12 4.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 71.420000000000002 110.916 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.475 ' C ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -83.78 -59.6 2.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.432 . . . . 62.409999999999997 110.898 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -153.85 -176.37 5.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 75.329999999999998 110.884 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -137.9 119.75 15.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 54.329999999999998 111.109 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.434 ' O ' ' N ' ' A' ' 38' ' ' GLU . . . -102.41 -174.73 2.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.31 -0.404 . . . . 53.439999999999998 111.157 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -45.35 93.16 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.722 -0.752 . . . . 72.409999999999997 112.506 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 36' ' ' ALA . 22.0 mt-10 58.68 40.53 23.22 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.905 0.383 . . . . 64.0 110.926 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.5 mtmm -150.93 157.93 43.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 63.299999999999997 110.845 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.5 t -135.13 117.45 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.172 -0.467 . . . . 71.439999999999998 111.175 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -82.3 135.02 35.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 75.109999999999999 110.935 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.589 ' CD1' HG23 ' A' ' 58' ' ' THR . 75.2 m95 -123.97 161.89 24.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.125 -0.489 . . . . 74.420000000000002 110.962 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -146.12 127.18 14.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.28 -0.418 . . . . 74.010000000000005 110.897 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.5 t -41.67 112.43 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.298 -0.41 . . . . 14.15 110.88 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.474 ' HB2' ' CZ ' ' A' ' 31' ' ' ARG . 19.8 ptt180 -42.28 -46.85 4.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 44.520000000000003 110.894 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.498 ' HB2' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -80.07 56.7 2.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.182 -0.463 . . . . 75.200000000000003 110.82 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.417 ' OE1' ' CA ' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -88.99 -38.75 14.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 75.219999999999999 110.88 -179.906 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.417 ' CA ' ' OE1' ' A' ' 47' ' ' GLN . . . -89.12 -68.97 0.74 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 70.439999999999998 111.099 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -41.64 -61.87 1.0 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.319999999999993 110.801 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.498 HD12 ' HB2' ' A' ' 46' ' ' ASP . 23.4 mt -77.75 -18.93 55.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 65.530000000000001 110.898 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.96 37.85 28.28 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.75 -0.738 . . . . 64.239999999999995 112.452 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.4 t -90.68 143.87 26.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.839 0.352 . . . . 63.009999999999998 110.887 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.8 mmt85 -125.54 31.49 5.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 63.420000000000002 110.906 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.7 t -88.7 137.58 32.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 64.430000000000007 110.897 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -125.63 141.87 51.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 75.329999999999998 110.938 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.46 152.11 51.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 62.240000000000002 111.095 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.584 HG22 ' N ' ' A' ' 58' ' ' THR . 91.8 mt -117.64 162.24 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 70.299999999999997 111.141 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.589 HG23 ' CD1' ' A' ' 42' ' ' TRP . 43.2 p -141.0 136.89 32.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 74.200000000000003 111.211 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.56 109.43 4.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 75.549999999999997 110.874 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 79.16 -101.03 1.81 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.763 -0.732 . . . . 54.43 112.45 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.638 ' HB3' HD11 ' A' ' 8' ' ' LEU . 1.3 t60 -128.96 9.17 5.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.735 0.302 . . . . 74.25 110.841 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.551 ' HG2' HD12 ' A' ' 8' ' ' LEU . 9.1 mmm180 -112.71 -179.82 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 75.510000000000005 110.826 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.902 HD13 ' CG ' ' A' ' 25' ' ' HIS . 14.4 tt -146.64 159.83 10.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 75.409999999999997 111.142 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.409 ' N ' HG12 ' A' ' 63' ' ' ILE . 36.5 mtm -139.73 152.28 46.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 73.519999999999996 110.843 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 50.3 t -119.62 139.58 46.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.219 -0.446 . . . . 72.540000000000006 111.135 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mmm -97.97 -51.79 3.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 74.319999999999993 110.868 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -128.13 172.74 10.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 63.020000000000003 110.902 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 51.0 p -87.68 -179.04 6.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 72.209999999999994 110.861 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.535 ' CD2' ' CE2' ' A' ' 28' ' ' PHE . 86.4 m-70 -111.05 136.56 49.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 65.120000000000005 110.902 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.5 p -79.45 -4.17 49.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 71.0 110.862 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.449 ' NE2' ' OD1' ' A' ' 46' ' ' ASP . 12.0 p80 -121.97 178.98 4.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 110.839 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -109.36 150.21 40.8 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.654 0.74 . . . . 45.299999999999997 110.873 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.76 155.29 66.32 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.668 2.246 . . . . 34.310000000000002 112.356 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -136.8 100.04 4.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.258 -0.428 . . . . 64.319999999999993 110.881 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mt -63.94 -21.42 66.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 73.340000000000003 110.875 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -76.51 -61.98 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 75.400000000000006 111.138 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.17 -33.49 64.92 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.763 -0.732 . . . . 74.409999999999997 112.512 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 tp -72.79 -48.1 40.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.775 0.321 . . . . 73.129999999999995 110.948 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -59.73 -29.1 67.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.451 . . . . 74.420000000000002 110.832 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.33 96.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 25.34 111.132 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 mt -75.96 -26.37 56.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.283 -0.417 . . . . 73.25 110.972 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.607 ' HG2' HD21 ' A' ' 14' ' ' LEU . 72.7 mtp85 -74.85 -34.17 62.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 71.109999999999999 110.905 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -58.29 -34.46 70.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 73.439999999999998 110.895 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -81.3 -3.46 52.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 71.519999999999996 110.83 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.87 -31.77 9.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 75.140000000000001 110.792 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.6 ptt-85 -88.55 8.17 29.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 73.129999999999995 110.871 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.657 HD22 ' C ' ' A' ' 87' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 75.150000000000006 110.87 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 112.497 -0.241 . . . . 73.239999999999995 112.497 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.9 p -82.73 76.13 9.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.848 0.356 . . . . 74.209999999999994 110.875 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.7 p -51.6 -51.11 58.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.091 -0.504 . . . . 71.129999999999995 110.828 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.93 -94.72 0.42 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.765 -0.731 . . . . 71.310000000000002 112.484 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 47.5 t -95.9 74.61 3.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.828 0.347 . . . . 61.210000000000001 110.851 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.4 t -55.27 123.76 14.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 74.420000000000002 110.86 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -127.71 -146.96 6.48 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.725 -0.75 . . . . 72.25 112.504 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.771 ' C ' HD12 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -66.51 100.38 0.66 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.78 0.324 . . . . 62.130000000000003 110.875 -179.9 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.56 ' N ' HD12 ' A' ' 8' ' ' LEU . 50.1 mtt180 -86.71 145.12 38.38 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.56 0.695 . . . . 74.430000000000007 110.865 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.423 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 54.0 Cg_endo -69.75 -169.89 0.36 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.679 2.252 . . . . 60.109999999999999 112.355 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.682 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 33.8 tp -151.54 149.49 29.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 73.120000000000005 110.91 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -105.33 151.9 23.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.183 -0.462 . . . . 72.530000000000001 110.891 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.682 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 66.4 m-85 -139.79 172.89 12.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 72.209999999999994 110.891 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.704 HD12 ' CG2' ' A' ' 24' ' ' VAL . 5.2 mt -147.27 156.5 42.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 65.299999999999997 110.881 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.0 tpp85 -126.03 140.58 52.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 74.409999999999997 110.806 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.44 ' OG1' ' N ' ' A' ' 20' ' ' GLY . 15.0 p -112.25 148.94 33.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.184 -0.462 . . . . 72.329999999999998 111.12 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 m -80.75 -46.63 15.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 72.209999999999994 110.886 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.1 mp -112.84 64.03 0.63 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.117 -0.492 . . . . 74.040000000000006 110.939 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 178.96 -109.31 0.26 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.684 -0.769 . . . . 44.409999999999997 112.528 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.44 ' N ' ' OG1' ' A' ' 16' ' ' THR . . . -154.33 -160.51 9.87 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.645 -0.788 . . . . 34.049999999999997 112.445 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -87.33 126.15 34.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.791 0.329 . . . . 73.530000000000001 110.864 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.421 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -99.61 167.78 10.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 73.340000000000003 110.893 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.493 HD11 HD21 ' A' ' 11' ' ' LEU . 7.0 tp -134.38 132.66 39.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 70.549999999999997 110.905 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.704 ' CG2' HD12 ' A' ' 14' ' ' LEU . 55.8 t -98.44 113.35 32.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 74.340000000000003 111.128 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.701 ' CG ' HD13 ' A' ' 63' ' ' ILE . 6.2 t60 -149.43 122.67 8.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 74.319999999999993 110.838 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 63.46 47.74 3.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.156 -0.474 . . . . 75.140000000000001 110.938 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.96 25.54 3.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 50.020000000000003 110.871 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -123.28 -179.17 4.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.082 -0.508 . . . . 72.450000000000003 110.903 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.507 HD21 ' CD1' ' A' ' 14' ' ' LEU . 22.6 mt -131.34 139.09 49.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.186 -0.461 . . . . 73.5 110.949 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.508 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -133.16 159.64 39.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.465 . . . . 71.319999999999993 110.924 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.421 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -123.47 124.57 43.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 62.340000000000003 110.912 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -46.37 112.94 0.55 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 63.310000000000002 110.838 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -90.35 -53.38 4.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 72.030000000000001 110.885 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.3 ptmm? -161.25 -176.61 5.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -143.67 133.3 23.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.27 -0.423 . . . . 43.119999999999997 111.075 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -109.82 69.14 0.69 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 64.109999999999999 111.079 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.77 -101.08 2.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.72 -0.752 . . . . 43.240000000000002 112.533 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -101.54 1.18 37.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.87 0.367 . . . . 70.540000000000006 110.924 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.409 ' CE ' HG21 ' A' ' 57' ' ' ILE . 48.2 mtpt -112.58 143.69 43.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.117 -0.492 . . . . 62.340000000000003 110.876 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.89 119.6 60.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 62.530000000000001 111.069 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.426 ' N ' ' CD1' ' A' ' 41' ' ' TYR . 6.5 m-30 -78.52 144.59 35.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.201 -0.454 . . . . 72.430000000000007 110.971 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.487 ' CD1' HG23 ' A' ' 58' ' ' THR . 79.7 m95 -136.08 123.09 21.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 64.109999999999999 110.939 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.8 ptt? -106.84 139.75 40.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 53.149999999999999 110.894 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.0 t -54.03 115.54 2.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 72.329999999999998 110.907 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 21.7 ptt-85 -41.59 -34.54 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 75.310000000000002 110.834 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -82.82 45.49 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 72.099999999999994 110.852 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.549 ' OE1' ' HB2' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -87.28 -27.97 22.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 73.430000000000007 110.937 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.549 ' HB2' ' OE1' ' A' ' 47' ' ' GLN . . . -97.85 -25.45 15.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 54.009999999999998 111.094 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 23.7 ttm-85 -90.8 -59.97 2.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 74.310000000000002 110.87 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.442 ' O ' ' N ' ' A' ' 52' ' ' CYS . 37.8 mt -96.53 22.7 7.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.2 -0.454 . . . . 72.510000000000005 110.888 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 37.76 29.63 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.822 -0.704 . . . . 75.340000000000003 112.536 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.442 ' N ' ' O ' ' A' ' 50' ' ' LEU . 4.7 t -80.92 99.32 8.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.827 0.346 . . . . 72.010000000000005 110.871 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 30.3 mmm-85 -80.6 7.38 10.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 74.25 110.869 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.9 t -54.82 110.92 0.72 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 54.420000000000002 110.83 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -112.36 166.97 10.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 64.409999999999997 110.916 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.692 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -148.36 166.67 27.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 53.509999999999998 111.11 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.409 HG21 ' CE ' ' A' ' 39' ' ' LYS . 86.8 mt -132.47 123.58 50.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 65.239999999999995 111.063 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.487 HG23 ' CD1' ' A' ' 42' ' ' TRP . 49.1 p -102.91 153.5 20.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.48 . . . . 64.530000000000001 111.161 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -153.12 109.82 3.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 51.229999999999997 110.857 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 71.46 -96.73 0.65 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.703 -0.761 . . . . 63.130000000000003 112.505 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.66 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -128.07 9.17 6.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.328 . . . . 71.120000000000005 110.857 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.466 ' HG3' HD13 ' A' ' 8' ' ' LEU . 14.8 mtp-105 -110.99 -176.92 3.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 64.140000000000001 110.858 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.701 HD13 ' CG ' ' A' ' 25' ' ' HIS . 19.4 tt -148.03 160.58 7.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.454 . . . . 63.439999999999998 111.072 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.692 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 8.1 ttp -142.53 148.44 37.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 74.420000000000002 110.847 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 93.4 t -118.57 141.97 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 72.120000000000005 111.091 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 9.4 mmm -105.59 -61.93 1.43 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 60.210000000000001 110.886 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.418 ' HD3' ' N ' ' A' ' 68' ' ' SER . 1.9 tmt_? -114.03 148.61 36.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 64.329999999999998 110.875 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.418 ' N ' ' HD3' ' A' ' 67' ' ' ARG . 13.7 p -68.73 -175.5 0.7 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 62.030000000000001 110.906 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -112.07 142.86 43.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 74.200000000000003 110.812 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.3 t -92.39 9.16 35.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 73.099999999999994 110.807 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 28.5 p80 -138.97 161.3 37.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 71.019999999999996 110.835 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -94.23 155.43 39.93 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.609 0.718 . . . . 64.409999999999997 110.945 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.82 155.55 65.43 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.709 2.273 . . . . 64.140000000000001 112.32 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -134.46 80.25 1.84 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.83 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.596 HD23 ' N ' ' A' ' 75' ' ' LEU . 0.7 OUTLIER -46.57 -24.16 0.49 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 75.019999999999996 110.947 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.53 -50.97 32.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.143 -0.481 . . . . 74.310000000000002 111.131 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.32 -37.88 80.62 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.679 -0.772 . . . . 63.530000000000001 112.473 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.434 HD21 HH11 ' A' ' 82' ' ' ARG . 6.0 tp -69.7 -41.8 74.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.779 0.323 . . . . 63.109999999999999 110.918 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -60.96 -23.3 65.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.137 -0.483 . . . . 70.340000000000003 110.845 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.75 -60.56 2.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 53.210000000000001 111.065 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.2 mt -52.86 -45.92 67.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 71.439999999999998 110.948 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.504 ' HG2' HD21 ' A' ' 14' ' ' LEU . 36.4 mtp180 -64.42 -24.3 67.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.46 . . . . 71.239999999999995 110.907 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -85.0 -31.8 23.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 72.239999999999995 110.917 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -72.49 -18.64 61.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 74.010000000000005 110.838 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -77.85 -35.94 50.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 63.210000000000001 110.945 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -90.57 52.52 2.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.115 -0.493 . . . . 72.409999999999997 110.836 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 116.209 -0.45 . . . . 73.230000000000004 110.94 179.99 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 112.425 -0.27 . . . . 63.520000000000003 112.425 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.2 p -124.87 130.19 51.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.902 0.382 . . . . 62.340000000000003 110.822 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 m -134.55 177.29 7.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.086 -0.506 . . . . 71.0 110.934 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.39 -167.2 22.46 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.707 -0.758 . . . . 73.310000000000002 112.464 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.6 m -92.39 161.79 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.922 0.392 . . . . 65.430000000000007 110.857 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.3 m -105.73 17.09 24.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 74.120000000000005 110.916 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.81 -51.21 2.7 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.755 -0.736 . . . . 75.439999999999998 112.557 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.54 HD12 ' HG3' ' A' ' 62' ' ' ARG . 15.2 tp -76.7 92.52 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.811 0.338 . . . . 65.209999999999994 110.928 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -82.09 144.0 50.18 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.687 0.756 . . . . 70.540000000000006 110.79 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.448 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 54.0 Cg_endo -69.76 -171.06 0.43 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.633 2.222 . . . . 72.549999999999997 112.37 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.853 HD21 HD11 ' A' ' 23' ' ' LEU . 15.4 tp -148.92 151.98 35.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.212 -0.449 . . . . 75.310000000000002 110.923 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -105.41 141.52 36.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 72.219999999999999 110.87 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.647 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 19.7 m-85 -139.36 170.18 16.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 75.420000000000002 110.921 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 mt -143.72 146.59 33.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.155 -0.475 . . . . 72.030000000000001 110.888 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 62.0 mtp85 -121.74 114.16 20.71 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 74.400000000000006 110.909 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -122.24 138.18 54.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.273 -0.422 . . . . 72.319999999999993 111.143 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.7 t -46.98 -57.93 4.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 64.200000000000003 110.831 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.402 ' N ' ' CD2' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -86.33 145.03 27.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 75.420000000000002 110.921 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.94 -30.96 4.12 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.776 -0.726 . . . . 51.130000000000003 112.518 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 103.23 -128.04 9.39 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.747 -0.74 . . . . 60.350000000000001 112.476 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 -103.43 156.39 17.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.812 0.339 . . . . 75.219999999999999 110.909 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -129.69 158.81 38.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 71.099999999999994 110.873 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.853 HD11 HD21 ' A' ' 11' ' ' LEU . 11.2 tp -122.22 115.34 22.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.194 -0.457 . . . . 65.319999999999993 110.908 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.5 t -89.95 116.33 31.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 72.209999999999994 111.158 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.806 ' CG ' HD13 ' A' ' 63' ' ' ILE . 14.3 t60 -153.97 129.25 9.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 71.530000000000001 110.889 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 62.66 37.76 12.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 74.409999999999997 110.904 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m 60.19 26.1 15.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 51.140000000000001 110.901 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.468 ' CE1' ' CE1' ' A' ' 71' ' ' HIS . 13.4 m-85 -126.82 -176.82 3.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 74.25 110.859 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.43 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 14.7 mt -134.33 134.25 41.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 63.409999999999997 110.915 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.508 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.1 m-85 -129.16 169.16 15.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.249 -0.432 . . . . 74.540000000000006 110.99 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -129.32 138.01 51.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 74.409999999999997 110.869 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.478 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 38.3 tttt -61.88 113.33 2.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 72.219999999999999 110.911 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -88.62 -47.56 8.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 74.430000000000007 110.909 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -157.28 169.27 25.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 74.140000000000001 110.906 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.72 123.14 23.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 73.0 111.152 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.3 34.73 1.39 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.449 . . . . 71.349999999999994 111.12 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.64 -88.7 0.94 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.708 -0.758 . . . . 64.239999999999995 112.537 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -92.29 -0.22 57.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.891 0.377 . . . . 63.329999999999998 110.883 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -121.6 157.78 30.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 72.120000000000005 110.837 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.456 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 2.5 t -138.46 112.9 8.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.236 -0.438 . . . . 70.530000000000001 111.123 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -77.11 139.3 39.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.114 -0.493 . . . . 71.109999999999999 110.978 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.585 ' CG ' HD22 ' A' ' 23' ' ' LEU . 81.6 m95 -128.48 165.98 19.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.148 -0.478 . . . . 63.350000000000001 110.889 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -151.84 140.68 20.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 73.530000000000001 110.919 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.0 t -51.06 106.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 71.030000000000001 110.872 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.43 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.3 ptt-85 -40.17 -33.63 0.25 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 63.340000000000003 110.844 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.97 52.35 0.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 65.519999999999996 110.874 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -73.12 -50.83 20.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.232 -0.44 . . . . 71.519999999999996 110.886 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.19 -10.01 26.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 74.209999999999994 111.028 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.3 ttt180 -84.03 -60.34 2.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 74.519999999999996 110.847 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 52' ' ' CYS . 94.3 mt -106.78 25.62 11.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.187 -0.461 . . . . 74.5 110.956 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.73 23.25 0.18 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.754 -0.736 . . . . 35.520000000000003 112.528 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 50' ' ' LEU . 6.1 t -77.46 141.44 39.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.791 0.329 . . . . 72.019999999999996 110.861 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.13 22.32 9.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 71.450000000000003 110.861 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.521 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 47.8 t -66.42 135.45 54.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 53.030000000000001 110.843 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 -128.72 160.5 32.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.086 -0.506 . . . . 71.230000000000004 110.839 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.445 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -154.86 150.3 27.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 25.41 111.067 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.463 HD12 ' CE ' ' A' ' 66' ' ' MET . 51.5 mt -120.38 131.61 72.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.446 . . . . 74.340000000000003 111.152 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.423 HG23 ' CD1' ' A' ' 42' ' ' TRP . 36.6 p -108.88 144.5 36.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 74.040000000000006 111.134 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -134.06 87.09 2.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.241 -0.436 . . . . 73.349999999999994 110.947 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.45 -87.07 1.55 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.753 -0.737 . . . . 73.409999999999997 112.413 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.492 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -126.25 -10.76 6.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.755 0.312 . . . . 70.340000000000003 110.871 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.54 ' HG3' HD12 ' A' ' 8' ' ' LEU . 51.8 mtm180 -92.4 -179.96 5.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.452 . . . . 74.420000000000002 110.951 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.806 HD13 ' CG ' ' A' ' 25' ' ' HIS . 19.8 tt -150.92 158.91 4.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 73.209999999999994 111.151 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.445 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 2.4 ttp -144.14 142.01 30.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 62.229999999999997 110.882 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 23.0 t -102.53 140.75 20.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 71.040000000000006 111.132 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.463 ' CE ' HD12 ' A' ' 57' ' ' ILE . 26.3 mmm -113.35 -64.12 1.35 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.506 . . . . 73.439999999999998 110.917 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -101.58 137.29 40.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 71.099999999999994 110.912 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 85.2 p -69.29 177.83 2.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 61.420000000000002 110.86 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.521 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 47.4 m-70 -111.52 145.74 38.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.102 -0.499 . . . . 72.319999999999993 110.886 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 8.6 t -97.44 13.78 28.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 70.120000000000005 110.955 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' HIS . . . . . 0.468 ' CE1' ' CE1' ' A' ' 28' ' ' PHE . 28.3 p80 -140.67 178.87 7.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.497 . . . . 62.420000000000002 110.833 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -111.46 152.2 43.78 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.589 0.709 . . . . 72.200000000000003 110.878 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.412 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.77 157.31 60.8 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.654 2.236 . . . . 63.219999999999999 112.328 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -135.93 83.64 2.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 75.349999999999994 110.841 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 12.6 mt -47.42 -29.54 2.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.227 -0.442 . . . . 71.230000000000004 110.901 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.96 -51.15 50.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.49 . . . . 52.119999999999997 111.162 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.65 -41.77 98.94 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.747 -0.739 . . . . 41.25 112.457 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tp -68.56 -51.51 41.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.793 0.33 . . . . 42.109999999999999 110.924 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -50.61 -22.59 2.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.439999999999998 110.858 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.781 ' HB1' ' NH1' ' A' ' 84' ' ' ARG . . . -69.55 -67.81 0.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 74.420000000000002 111.06 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.414 ' C ' ' O ' ' A' ' 80' ' ' ALA . 6.6 mt -37.4 -52.31 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 65.019999999999996 110.904 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -52.5 -56.58 14.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.453 . . . . 74.239999999999995 110.848 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.445 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 0.6 OUTLIER -66.62 -19.18 65.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 74.329999999999998 110.956 -179.914 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.781 ' NH1' ' HB1' ' A' ' 80' ' ' ALA . 16.7 mtt85 -86.14 -27.88 24.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 74.319999999999993 110.834 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -69.75 -40.56 76.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 73.400000000000006 110.865 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -122.89 169.61 10.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 74.319999999999993 110.909 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 24.3 tp . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 74.430000000000007 110.917 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 112.501 -0.24 . . . . 32.219999999999999 112.501 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.6 t -151.05 120.28 6.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.9 0.381 . . . . 52.210000000000001 110.936 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.5 t -69.12 102.73 1.72 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 65.530000000000001 110.852 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -38.55 135.91 1.13 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.811 -0.709 . . . . 63.299999999999997 112.453 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.5 t -96.96 134.93 39.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.858 0.361 . . . . 54.399999999999999 110.921 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.1 t -92.34 2.44 56.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 74.409999999999997 110.83 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 157.31 -116.42 0.72 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.753 -0.736 . . . . 71.430000000000007 112.506 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.713 ' C ' HD12 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -153.97 133.53 12.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.794 0.33 . . . . 70.510000000000005 110.973 -179.997 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.647 ' O ' HD12 ' A' ' 8' ' ' LEU . 61.0 mtp85 -66.68 143.77 98.28 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.581 0.705 . . . . 75.140000000000001 110.87 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.612 ' HB3' ' CE1' ' A' ' 61' ' ' HIS . 53.3 Cg_endo -69.82 -170.78 0.42 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.687 2.258 . . . . 74.239999999999995 112.312 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.668 HD21 HD11 ' A' ' 23' ' ' LEU . 27.9 tp -130.62 143.88 51.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 64.150000000000006 110.909 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -88.06 134.4 33.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 74.120000000000005 110.915 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.654 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 64.2 m-85 -133.56 172.87 12.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.123 -0.49 . . . . 74.349999999999994 110.886 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.621 HD12 ' CG2' ' A' ' 24' ' ' VAL . 10.9 mt -146.82 150.26 34.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.158 -0.474 . . . . 54.509999999999998 110.891 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 -127.54 116.44 20.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.466 . . . . 73.230000000000004 110.838 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.475 HG21 ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -122.14 150.34 42.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.165 -0.471 . . . . 63.049999999999997 111.168 -179.938 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.8 t -80.8 -52.71 7.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 70.200000000000003 110.885 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.3 mt -80.95 67.66 6.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 74.420000000000002 110.873 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 159.02 -54.58 0.36 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.732 -0.747 . . . . 65.310000000000002 112.456 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 132.44 -128.53 5.23 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.722 -0.751 . . . . 74.120000000000005 112.492 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 tpp85 -106.07 136.26 46.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.898 0.38 . . . . 73.129999999999995 110.83 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.475 ' CE2' HG21 ' A' ' 16' ' ' THR . 2.7 m-85 -117.01 158.19 24.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 74.439999999999998 110.943 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.668 HD11 HD21 ' A' ' 11' ' ' LEU . 13.7 tp -124.88 115.99 21.51 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 75.129999999999995 110.939 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.621 ' CG2' HD12 ' A' ' 14' ' ' LEU . 41.4 t -90.62 113.53 26.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 71.120000000000005 111.107 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.627 ' CG ' HD13 ' A' ' 63' ' ' ILE . 15.3 t60 -148.43 124.51 10.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 71.430000000000007 110.868 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 62.73 44.37 6.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 74.099999999999994 110.87 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.6 m 55.79 25.27 8.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 62.530000000000001 110.793 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -125.99 172.93 9.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 70.439999999999998 110.86 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.474 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 33.5 mt -125.94 134.45 51.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 62.310000000000002 110.92 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.49 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.6 m-85 -127.75 167.3 16.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 74.400000000000006 110.912 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -132.6 133.37 43.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 74.230000000000004 110.903 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.533 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 73.5 tttt -55.81 114.92 2.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.246 -0.434 . . . . 72.310000000000002 110.935 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -88.88 -57.22 2.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 73.329999999999998 110.842 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.529 ' HD2' ' CG ' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -151.45 -177.69 6.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 64.349999999999994 110.85 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -132.92 138.92 47.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.461 . . . . 74.450000000000003 111.124 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -110.72 35.98 3.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 61.310000000000002 111.107 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.1 -78.59 0.52 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.843 -0.694 . . . . 72.120000000000005 112.466 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -105.02 -20.4 13.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.91 0.386 . . . . 74.150000000000006 110.875 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -98.98 163.94 12.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.197 -0.456 . . . . 64.329999999999998 110.902 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.0 t -134.32 120.68 34.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 61.420000000000002 111.104 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.529 ' CG ' ' HD2' ' A' ' 34' ' ' LYS . 2.9 m-85 -79.34 142.26 36.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 75.5 110.878 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.533 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 80.6 m95 -134.93 150.69 50.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 72.099999999999994 110.905 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -133.06 138.03 46.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 53.240000000000002 110.876 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.403 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.9 t -51.3 104.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 61.329999999999998 110.895 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.474 ' CZ ' HD13 ' A' ' 29' ' ' LEU . 15.9 ptt180 -40.47 -28.4 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.829 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 44' ' ' CYS . 2.9 m-20 -87.86 48.49 1.65 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.248 -0.433 . . . . 71.439999999999998 110.882 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -83.3 -40.45 19.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.198 -0.456 . . . . 75.319999999999993 110.892 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.37 -9.55 38.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 65.030000000000001 111.071 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -97.33 -55.26 2.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 73.510000000000005 110.838 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.436 ' O ' ' C ' ' A' ' 51' ' ' GLY . 28.4 mt -106.69 26.9 9.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 75.200000000000003 110.938 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.436 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.62 56.13 0.78 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.677 -0.773 . . . . 61.399999999999999 112.529 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.6 t -126.47 118.34 24.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.835 0.35 . . . . 54.119999999999997 110.893 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.9 mmt-85 -93.44 2.74 56.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.205 -0.452 . . . . 74.420000000000002 110.874 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.468 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 37.8 t -40.82 105.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 72.109999999999999 110.871 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -102.93 -179.74 4.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 74.099999999999994 110.878 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.812 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -162.62 167.04 23.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 74.319999999999993 111.15 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 57.8 mt -131.52 123.89 53.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.287 -0.415 . . . . 70.209999999999994 111.11 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.84 HG22 HG13 ' A' ' 63' ' ' ILE . 31.3 p -108.92 141.19 41.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 75.310000000000002 111.133 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -147.24 111.54 5.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 70.530000000000001 110.886 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.73 -102.42 2.35 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.823 -0.704 . . . . 63.240000000000002 112.507 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.644 ' HB3' HD11 ' A' ' 8' ' ' LEU . 3.7 t-160 -129.0 10.35 5.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.786 0.327 . . . . 74.0 110.87 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.606 ' CD ' HD13 ' A' ' 8' ' ' LEU . 1.5 mmp_? -113.27 -174.99 2.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 74.219999999999999 110.893 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.84 HG13 HG22 ' A' ' 58' ' ' THR . 18.5 tt -150.02 152.8 11.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 72.349999999999994 111.117 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.812 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 21.4 mtm -134.52 148.77 50.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 62.329999999999998 110.878 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.3 t -117.23 138.21 48.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 63.409999999999997 111.093 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 11.2 mtp -107.96 -54.69 2.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.485 . . . . 65.450000000000003 110.923 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.74 160.52 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 63.229999999999997 110.898 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 p -95.75 167.04 11.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 72.329999999999998 110.844 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.468 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 38.0 m-70 -104.07 129.97 51.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 74.450000000000003 110.82 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.0 t -89.06 13.11 13.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.163 -0.471 . . . . 55.210000000000001 110.868 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 19.1 p80 -133.34 172.79 12.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 74.109999999999999 110.837 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -104.65 151.41 39.27 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.711 . . . . 75.340000000000003 110.926 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 151.6 69.06 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.666 2.244 . . . . 73.239999999999995 112.303 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -112.7 81.76 1.54 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.189 -0.46 . . . . 54.109999999999999 110.834 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.9 mt -51.33 -17.69 0.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 52.140000000000001 110.857 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.86 -55.1 3.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 31.52 111.12 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.99 -37.52 91.59 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.717 -0.754 . . . . 52.299999999999997 112.526 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 12.6 tp -68.87 -51.01 44.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.779 0.323 . . . . 65.209999999999994 110.946 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -53.34 -30.93 41.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 75.200000000000003 110.87 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.05 -28.54 66.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 41.32 111.09 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mt -79.2 -39.02 34.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 72.299999999999997 110.885 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.506 ' HG2' HD21 ' A' ' 14' ' ' LEU . 4.0 mtp-105 -72.88 -42.68 63.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 72.510000000000005 110.847 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.472 ' CG ' ' N ' ' A' ' 84' ' ' ARG . 2.4 pt20 -60.1 -46.37 89.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 72.310000000000002 110.9 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.472 ' N ' ' CG ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -67.99 -32.28 72.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.25 -0.432 . . . . 75.129999999999995 110.863 -179.901 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 84' ' ' ARG . 0.9 OUTLIER -34.46 -48.79 0.37 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 74.150000000000006 110.885 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 65.2 mtp180 -87.14 154.48 20.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 64.510000000000005 110.824 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 8.2 mp . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 65.239999999999995 110.904 -179.975 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.364 0 N-CA-C 112.552 -0.219 . . . . 55.420000000000002 112.552 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 t -50.5 95.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.93 0.395 . . . . 64.099999999999994 110.802 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m -121.11 161.33 21.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 54.32 110.858 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 177.43 177.57 46.39 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.687 -0.768 . . . . 23.23 112.477 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.6 t -98.04 -34.99 10.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.945 0.402 . . . . 75.150000000000006 110.883 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.8 p -110.14 97.3 6.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 73.099999999999994 110.859 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 174.88 -122.1 0.86 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.75 -0.738 . . . . 73.230000000000004 112.502 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.839 HD12 ' HG3' ' A' ' 62' ' ' ARG . 0.5 OUTLIER -124.99 174.46 7.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.775 0.321 . . . . 73.430000000000007 110.971 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.466 ' CG ' ' HD2' ' A' ' 10' ' ' PRO . 16.1 ttm180 -106.14 143.23 26.51 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.603 0.716 . . . . 75.0 110.913 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.466 ' HD2' ' CG ' ' A' ' 9' ' ' ARG . 54.5 Cg_endo -69.75 -170.04 0.37 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.619 2.213 . . . . 71.400000000000006 112.417 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.553 HD22 ' HB ' ' A' ' 63' ' ' ILE . 11.8 tp -151.27 147.81 27.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 74.310000000000002 110.872 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 13' ' ' PHE . 8.1 tp10 -103.56 146.57 28.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 74.230000000000004 110.958 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.409 ' N ' ' HG3' ' A' ' 12' ' ' GLU . 25.7 m-85 -139.44 172.93 12.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 72.219999999999999 110.84 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.9 mt -142.06 157.68 44.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 73.040000000000006 110.905 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.426 ' N ' ' HD2' ' A' ' 15' ' ' ARG . 2.5 mpt_? -125.3 119.55 28.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 72.420000000000002 110.849 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.65 132.83 54.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 70.0 111.128 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.9 m -64.73 -24.77 67.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 44.329999999999998 110.859 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.833 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -114.82 81.04 1.5 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 63.340000000000003 110.927 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 149.72 -24.95 1.18 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.758 -0.734 . . . . 70.420000000000002 112.484 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.51 -96.95 1.32 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.76 -0.733 . . . . 65.409999999999997 112.493 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -134.73 137.78 43.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.817 0.341 . . . . 71.120000000000005 110.892 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -112.55 159.75 18.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.29 -0.414 . . . . 74.129999999999995 110.927 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.406 HD11 HD21 ' A' ' 11' ' ' LEU . 6.7 tp -131.96 130.72 41.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 73.299999999999997 110.953 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.7 t -97.1 111.43 27.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 44.219999999999999 111.137 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.663 ' CD2' HD13 ' A' ' 63' ' ' ILE . 2.3 t60 -148.05 129.55 14.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.429 . . . . 75.299999999999997 110.855 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 59.88 38.59 21.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 73.140000000000001 110.892 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 m 61.22 18.29 9.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.484 . . . . 73.310000000000002 110.863 -179.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -116.71 179.53 3.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 65.030000000000001 110.85 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 27.9 mt -130.37 135.4 48.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 74.140000000000001 110.886 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.499 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 1.2 m-85 -128.37 163.01 25.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.278 -0.419 . . . . 74.25 110.911 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.4 mtt180 -117.48 126.55 52.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 70.310000000000002 110.808 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.509 ' HB2' ' CZ3' ' A' ' 42' ' ' TRP . 54.2 tttt -54.55 110.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 71.450000000000003 110.882 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.429 ' C ' ' CD ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -81.38 -58.63 2.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 61.140000000000001 110.934 179.895 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.83 -177.57 5.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 75.150000000000006 110.884 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -141.03 109.31 5.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 64.129999999999995 111.13 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.61 90.31 7.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 71.329999999999998 111.083 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 58.35 -92.89 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.737 -0.744 . . . . 74.430000000000007 112.505 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.446 ' CD ' ' N ' ' A' ' 38' ' ' GLU . 9.1 mp0 -106.99 9.97 30.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 74.109999999999999 110.871 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.5 mtmt -116.48 155.76 28.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 63.340000000000003 110.96 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 15.4 t -134.51 122.6 40.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.313 -0.403 . . . . 55.329999999999998 111.139 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -87.18 141.8 28.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.465 . . . . 63.409999999999997 110.851 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' TRP . . . . . 0.509 ' CZ3' ' HB2' ' A' ' 32' ' ' LYS . 67.5 m95 -135.29 163.38 30.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.082 -0.508 . . . . 75.299999999999997 110.94 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 12.3 ptt? -150.17 140.36 22.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.3 -0.409 . . . . 73.549999999999997 110.919 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -52.85 107.58 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 73.120000000000005 110.889 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.1 ptt-85 -40.23 -31.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 75.219999999999999 110.947 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -81.96 43.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 75.409999999999997 110.888 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -85.33 -34.93 21.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.209 -0.45 . . . . 72.25 110.866 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -96.24 -14.97 22.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 63.420000000000002 111.035 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -97.04 -58.72 1.95 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.271 -0.422 . . . . 71.0 110.901 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.0 mt -99.49 21.9 11.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 75.209999999999994 110.926 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.56 37.82 1.97 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.764 -0.732 . . . . 73.310000000000002 112.43 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 30.9 t -93.87 110.42 22.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.82 0.343 . . . . 41.140000000000001 110.838 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.414 ' O ' ' CD ' ' A' ' 55' ' ' ARG . 0.9 OUTLIER -91.94 19.38 6.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 74.010000000000005 110.893 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.5 t -63.09 108.49 1.25 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 73.510000000000005 110.92 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.469 ' HB3' ' HE2' ' A' ' 66' ' ' MET . 1.1 mpt_? -107.06 156.4 18.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 71.340000000000003 110.888 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -138.8 167.68 21.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.310000000000002 111.117 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.778 ' HB ' ' HE3' ' A' ' 64' ' ' MET . 55.2 mt -141.57 123.42 13.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.192 -0.458 . . . . 65.230000000000004 111.104 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.824 HG22 HG13 ' A' ' 63' ' ' ILE . 18.4 p -109.33 149.94 28.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.113 -0.494 . . . . 71.439999999999998 111.149 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.47 89.06 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 72.409999999999997 110.867 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 86.61 -87.56 1.56 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.733 -0.746 . . . . 71.200000000000003 112.477 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' HIS . . . . . 0.477 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER -126.5 -8.19 6.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.817 0.341 . . . . 52.130000000000003 110.898 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.839 ' HG3' HD12 ' A' ' 8' ' ' LEU . 21.6 mtt180 -91.4 -177.4 4.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 65.140000000000001 110.855 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.824 HG13 HG22 ' A' ' 58' ' ' THR . 5.9 tt -150.49 153.8 9.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 73.219999999999999 111.122 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' MET . . . . . 0.778 ' HE3' ' HB ' ' A' ' 57' ' ' ILE . 3.6 tmm? -138.87 151.52 47.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 71.200000000000003 110.85 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.7 t -111.58 134.07 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 75.230000000000004 111.173 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.469 ' HE2' ' HB3' ' A' ' 55' ' ' ARG . 13.0 mtm -103.26 -36.03 8.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 60.210000000000001 110.871 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -140.05 160.18 40.51 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.245 -0.434 . . . . 75.150000000000006 110.899 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.2 m -86.11 -179.52 6.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.186 -0.461 . . . . 74.010000000000005 110.826 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 70.6 m-70 -113.15 137.44 51.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 71.420000000000002 110.844 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.8 t -94.24 14.27 20.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 61.409999999999997 110.883 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -140.69 173.6 11.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 71.430000000000007 110.822 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -106.34 152.29 40.5 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.589 0.709 . . . . 60.43 110.832 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 167.02 25.71 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.719 2.279 . . . . 74.450000000000003 112.358 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -144.35 82.93 1.71 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.28 -0.418 . . . . 72.430000000000007 110.866 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.1 mt -47.03 -25.47 0.83 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 72.310000000000002 110.895 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.25 -42.52 83.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.049999999999997 111.102 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.61 -38.31 21.0 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.777 -0.725 . . . . 72.120000000000005 112.468 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tp -67.64 -41.45 83.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.75 0.309 . . . . 43.229999999999997 110.915 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -63.81 -25.56 68.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.192 -0.458 . . . . 75.200000000000003 110.906 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.39 -51.6 59.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 41.509999999999998 111.138 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.18 -30.78 71.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 74.299999999999997 110.869 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mtp-105 -81.23 -20.78 40.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.446 . . . . 62.240000000000002 110.92 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.16 -32.97 59.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 73.430000000000007 110.937 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -86.56 -7.74 58.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 72.200000000000003 110.885 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -108.92 -12.78 14.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.198 -0.455 . . . . 64.129999999999995 110.896 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.402 ' O ' ' CZ ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -94.18 17.75 12.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 75.230000000000004 110.89 -179.942 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 64.409999999999997 110.932 -179.998 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.485 HD21 HD11 ' A' ' 23' ' ' LEU . 16.4 tp . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.799 0.333 . . . . 52.42 110.888 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -106.19 150.24 26.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 61.13 110.875 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -137.81 172.47 12.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 71.13 110.807 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.43 HD21 ' CG ' ' A' ' 82' ' ' ARG . 8.5 mt -142.11 157.53 44.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.065 -0.516 . . . . 63.43 110.883 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 64.21 110.875 179.887 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.836 0.351 . . . . 63.24 110.904 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -99.49 167.88 10.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 73.13 110.927 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.485 HD11 HD21 ' A' ' 11' ' ' LEU . 10.0 tp -129.43 125.98 37.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 73.04 110.951 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.578 HG11 ' NH2' ' A' ' 82' ' ' ARG . 77.6 t -95.38 116.57 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 64.23 111.119 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.801 ' CG ' HD13 ' A' ' 63' ' ' ILE . 9.0 t60 -154.77 126.08 7.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 72.44 110.902 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 63.89 38.51 8.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 73.42 110.847 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.1 m 58.55 24.61 12.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 71.24 110.858 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -121.52 -177.3 3.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.115 -0.493 . . . . 74.02 110.887 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.574 HD12 ' HE ' ' A' ' 45' ' ' ARG . 69.8 mt -132.76 132.98 42.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.093 -0.503 . . . . 45.41 110.935 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.499 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -127.63 170.07 13.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.175 -0.466 . . . . 73.45 110.888 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.452 ' NE ' ' HB2' ' A' ' 45' ' ' ARG . 20.3 mtt180 -131.18 137.09 48.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 55.43 110.83 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.45 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 37.6 tttt -64.42 110.52 2.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 62.45 110.9 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -82.66 -59.25 2.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 63.42 110.888 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.484 ' HE2' ' CD2' ' A' ' 41' ' ' TYR . 10.1 pttm -142.81 177.87 8.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.852 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -142.79 120.8 12.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.245 -0.434 . . . . 62.14 111.098 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.85 32.68 0.8 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 70.23 111.1 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.07 -60.31 4.91 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.753 -0.737 . . . . 73.04 112.508 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -105.79 -13.04 15.66 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.864 0.364 . . . . 74.22 110.859 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.444 ' HG2' ' CG ' ' A' ' 59' ' ' GLN . 36.2 mtmt -121.24 148.36 44.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.158 -0.474 . . . . 74.33 110.877 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.414 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 3.5 t -125.76 111.12 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 72.4 111.152 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.484 ' CD2' ' HE2' ' A' ' 34' ' ' LYS . 3.6 m-85 -79.72 141.77 36.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 61.25 110.928 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.475 ' CD1' HG23 ' A' ' 58' ' ' THR . 63.6 m95 -130.29 166.28 20.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.033 -0.53 . . . . 75.41 110.938 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.0 ptt? -146.75 135.49 22.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 64.14 110.879 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.9 t -50.16 109.6 0.31 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 63.43 110.869 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.574 ' HE ' HD12 ' A' ' 29' ' ' LEU . 39.1 ptt85 -44.48 -23.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 74.43 110.923 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.485 ' HB3' HD12 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -85.47 30.86 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 61.33 110.856 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -82.01 -26.11 34.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 75.02 110.913 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.04 -23.56 16.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 71.31 111.17 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.0 tpp85 -96.7 -60.56 1.58 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.477 . . . . 64.21 110.86 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.535 HD13 ' CG ' ' A' ' 71' ' ' HIS . 34.8 mt -94.34 22.79 5.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 71.42 110.889 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 38.08 41.88 1.08 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.742 -0.742 . . . . 63.21 112.486 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.2 t -90.26 120.76 31.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.907 0.384 . . . . 70.1 110.814 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -99.3 13.33 33.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 63.33 110.862 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.7 t -65.03 117.74 8.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 64.24 110.874 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -114.87 159.4 20.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 75.22 110.917 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.697 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -144.74 164.45 30.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 71.32 111.097 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 64' ' ' MET . 69.1 mt -127.25 129.23 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.32 111.124 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.475 HG23 ' CD1' ' A' ' 42' ' ' TRP . 42.2 p -110.36 136.84 48.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 63.1 111.156 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.444 ' CG ' ' HG2' ' A' ' 39' ' ' LYS . 4.7 mt-30 -144.48 116.23 8.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 74.12 110.945 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 70.19 -99.2 0.69 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.71 -0.757 . . . . 64.2 112.535 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.26 4.84 5.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.763 0.316 . . . . 75.01 110.803 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 42.5 mtm180 -107.01 -175.22 2.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.21 110.817 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.801 HD13 ' CG ' ' A' ' 25' ' ' HIS . 21.3 tt -150.81 162.75 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 70.2 111.074 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.697 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 3.9 mpp? -141.6 147.66 37.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.108 -0.496 . . . . 62.22 110.864 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.7 t -116.76 130.13 72.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 71.04 111.121 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 19.4 mtp -89.42 -64.08 1.19 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.211 -0.449 . . . . 72.32 110.852 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.9 ttm180 -112.34 175.93 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.268 -0.424 . . . . 74.13 110.901 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.4 p -90.99 -176.18 4.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 75.32 110.909 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.433 ' CE1' ' HH ' ' A' ' 30' ' ' TYR . 88.3 m-70 -114.17 137.71 51.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 74.04 110.889 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.3 t -93.27 13.88 19.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.234 -0.439 . . . . 71.42 110.839 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.535 ' CG ' HD13 ' A' ' 50' ' ' LEU . 26.7 p80 -141.48 169.29 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 74.31 110.866 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.441 ' CD ' ' N ' ' A' ' 72' ' ' GLN . 1.8 mp0 -102.57 151.79 38.29 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.576 0.703 . . . . 55.54 110.92 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.88 149.6 66.32 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.639 2.226 . . . . 63.33 112.347 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -124.76 81.14 1.92 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 75.54 110.816 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.403 ' N ' HD23 ' A' ' 75' ' ' LEU . 6.5 mt -48.75 -22.9 0.88 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 62.35 110.919 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -75.24 -41.33 57.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.4 111.103 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -80.68 -31.38 36.59 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.724 -0.75 . . . . 71.42 112.486 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.6 tp -68.72 -38.31 80.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.707 0.289 . . . . 72.31 110.891 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -70.3 -34.72 73.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.187 -0.46 . . . . 75.33 110.896 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.93 -20.09 66.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 73.42 111.062 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.518 HD13 ' CD1' ' A' ' 29' ' ' LEU . 3.0 mt -90.15 -21.92 21.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 73.54 110.888 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.578 ' NH2' HG11 ' A' ' 24' ' ' VAL . 28.9 mtt180 . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 74.34 110.877 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.74 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 14.5 tp . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.735 0.302 . . . . 74.24 110.931 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.449 ' C ' ' CD1' ' A' ' 13' ' ' PHE . 34.0 tt0 -113.52 145.73 40.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 72.51 110.911 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.74 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 0.8 OUTLIER -140.0 167.9 21.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 75.4 110.898 -179.925 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.859 HD21 ' HG2' ' A' ' 82' ' ' ARG . 8.9 mt -137.57 117.53 13.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 63.42 111.012 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 72.21 110.903 179.953 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.811 0.339 . . . . 63.33 110.833 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -110.95 164.27 12.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 63.11 110.909 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.635 HD11 HD21 ' A' ' 11' ' ' LEU . 5.4 tp -129.16 113.68 15.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 74.54 110.962 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -88.01 112.08 23.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 74.03 111.11 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.808 ' CG ' HD13 ' A' ' 63' ' ' ILE . 9.2 t60 -149.27 125.49 10.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.151 -0.477 . . . . 72.44 110.821 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 63.21 42.96 6.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.24 -0.436 . . . . 75.11 110.904 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.7 m 56.05 19.94 4.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 45.15 110.902 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -116.83 -175.42 2.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.016 -0.538 . . . . 63.12 110.915 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.5 mt -136.61 133.6 36.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.161 -0.472 . . . . 71.34 110.922 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.515 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -129.23 163.06 26.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 73.43 110.914 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.8 mtp180 -124.77 139.88 53.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 71.2 110.928 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.8 tttt -60.91 116.18 4.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 72.12 110.898 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -91.97 -57.57 2.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 75.21 110.904 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.7 pttt -151.32 168.48 24.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 63.14 110.924 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -132.7 119.19 20.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 63.1 111.09 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -82.54 38.01 0.54 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 74.34 111.067 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.21 -50.59 4.0 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.755 -0.736 . . . . 60.1 112.5 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -114.44 -27.81 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.908 0.385 . . . . 54.52 110.878 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.767 ' HE2' HD13 ' A' ' 57' ' ' ILE . 52.0 mtpt -104.61 154.81 19.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 73.2 110.883 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 t -127.87 111.97 26.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.275 -0.421 . . . . 74.23 111.102 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.521 ' CZ ' HD11 ' A' ' 57' ' ' ILE . 3.4 m-85 -79.45 145.27 33.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 62.13 110.893 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.619 ' CD1' HG23 ' A' ' 58' ' ' THR . 66.5 m95 -135.3 163.14 30.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.117 -0.492 . . . . 73.14 110.875 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.9 ptt? -145.79 132.06 19.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 71.02 110.909 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.406 ' C ' ' N ' ' A' ' 46' ' ' ASP . 1.8 t -46.1 108.46 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 72.44 110.813 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -43.49 -23.65 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 70.35 110.858 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.446 ' CB ' HD12 ' A' ' 50' ' ' LEU . 3.3 m-20 -81.39 42.06 0.65 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 64.51 110.822 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -85.8 -36.09 20.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 71.23 110.934 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.89 -14.57 20.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 63.31 111.128 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -98.91 -53.71 3.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 60.15 110.914 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.447 ' O ' ' C ' ' A' ' 51' ' ' GLY . 33.9 mt -108.01 27.34 9.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.201 -0.454 . . . . 72.44 110.903 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.447 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.63 47.08 0.61 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.761 -0.733 . . . . 70.41 112.484 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.3 t -97.59 142.71 29.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.759 0.314 . . . . 40.04 110.895 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.43 ' N ' ' HD2' ' A' ' 53' ' ' ARG . 0.4 OUTLIER -118.37 -0.87 11.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.172 -0.467 . . . . 74.14 110.926 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.556 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . 1.1 t -52.43 116.13 2.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.205 -0.452 . . . . 64.03 110.862 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.6 mtm105 -111.14 171.16 7.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 72.04 110.819 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.635 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -160.68 151.32 18.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 74.42 111.092 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.767 HD13 ' HE2' ' A' ' 39' ' ' LYS . 23.0 mt -115.49 130.16 70.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 74.22 111.099 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.619 HG23 ' CD1' ' A' ' 42' ' ' TRP . 28.3 p -111.32 141.47 44.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 50.21 111.156 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.415 ' NE2' ' HG2' ' A' ' 39' ' ' LYS . 10.7 mt-30 -146.72 109.3 4.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 75.25 110.9 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 75.29 -95.95 0.98 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.718 -0.753 . . . . 72.42 112.448 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -129.03 1.18 5.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.804 0.335 . . . . 73.42 110.818 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.7 mmm-85 -102.79 -176.41 3.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 74.13 110.894 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.808 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.4 161.97 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.199 -0.455 . . . . 63.44 111.158 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.635 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 16.8 ttm -138.62 141.28 39.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 61.22 110.933 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.2 t -106.41 133.25 51.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 53.03 111.129 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 23.5 mmt -93.87 -65.1 1.01 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 74.12 110.956 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -119.5 -178.27 3.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 63.53 110.903 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 77.3 p -91.82 -175.36 4.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 73.02 110.895 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.556 ' CE1' ' HB3' ' A' ' 54' ' ' SER . 75.8 m-70 -117.84 144.09 45.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 63.05 110.896 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 90.0 m -97.07 11.2 37.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 72.03 110.873 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 28.6 p80 -139.08 166.28 24.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 72.31 110.873 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -97.7 152.29 38.06 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.569 0.699 . . . . 74.05 110.953 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.71 160.31 50.2 Favored 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 122.755 2.303 . . . . 64.23 112.264 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.24 93.48 2.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.115 -0.493 . . . . 75.52 110.841 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.754 HD23 ' N ' ' A' ' 75' ' ' LEU . 0.5 OUTLIER -60.99 -22.18 64.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 74.24 110.93 -179.93 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.2 -55.38 9.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 63.13 111.124 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.22 -29.1 74.29 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.687 -0.768 . . . . 73.23 112.536 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 10.9 tp -77.33 -48.59 16.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.788 0.327 . . . . 60.02 110.896 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -64.19 -25.0 67.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 63.55 110.849 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.44 -25.73 63.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 74.41 111.121 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mt -79.12 -49.63 12.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.166 -0.47 . . . . 62.21 110.915 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.859 ' HG2' HD21 ' A' ' 14' ' ' LEU . 19.8 mtm180 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.481 . . . . 54.54 110.907 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.743 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 15.8 tp . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.781 0.324 . . . . 71.54 110.875 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -106.42 151.04 25.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 43.13 110.85 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.743 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 48.9 m-85 -139.98 170.52 15.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 74.42 110.866 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.5 mt -143.89 162.25 36.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 71.24 110.936 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.7 mtt85 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 74.31 110.896 179.93 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.803 0.335 . . . . 73.52 110.899 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -116.04 165.29 13.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 75.24 110.904 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.591 HD22 ' CG ' ' A' ' 42' ' ' TRP . 10.6 tp -131.71 117.59 18.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 73.24 110.86 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.685 HG11 ' NH2' ' A' ' 82' ' ' ARG . 97.5 t -93.55 111.7 25.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.453 . . . . 73.33 111.101 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.817 ' CG ' HD13 ' A' ' 63' ' ' ILE . 57.5 t60 -147.98 132.61 17.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 73.24 110.832 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.422 ' HG3' ' NE2' ' A' ' 25' ' ' HIS . 23.6 mt-10 59.6 35.58 22.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 73.21 110.892 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m 63.43 29.32 15.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 75.04 110.909 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 22.1 m-85 -130.72 -178.17 4.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 70.34 110.91 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.408 HD13 ' HE ' ' A' ' 45' ' ' ARG . 16.2 mt -133.38 133.15 42.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 72.5 110.913 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.495 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.2 m-85 -125.71 161.51 27.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 60.23 110.919 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.473 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 3.3 mtt-85 -115.63 126.35 54.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 72.4 110.822 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.505 ' HB2' ' CH2' ' A' ' 42' ' ' TRP . 15.6 ttpt -57.45 110.07 0.8 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.451 . . . . 73.41 110.86 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -82.38 -58.14 3.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 74.43 110.891 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.1 pttp -149.88 -176.66 5.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 45.33 110.88 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.58 117.17 7.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 65.52 111.173 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.34 80.23 4.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 51.12 111.098 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.68 -78.14 0.37 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.717 -0.754 . . . . 64.41 112.503 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -116.19 -13.8 11.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.963 0.411 . . . . 74.43 110.938 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.634 ' HE3' HG21 ' A' ' 57' ' ' ILE . 26.8 mtpp -94.08 149.64 21.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.114 -0.494 . . . . 75.43 110.937 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.408 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 1.7 t -132.55 118.99 37.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 72.35 111.126 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -87.49 134.22 33.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 74.45 110.898 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.591 ' CG ' HD22 ' A' ' 23' ' ' LEU . 68.5 m95 -124.32 168.17 13.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 73.4 110.893 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -152.86 133.54 13.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.246 -0.434 . . . . 75.54 110.866 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -42.89 111.02 0.22 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.43 . . . . 73.31 110.888 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 31' ' ' ARG . 37.0 ptt85 -52.36 -19.32 2.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 72.32 110.844 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.16 10.81 3.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.181 -0.463 . . . . 73.05 110.895 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.42 ' NE2' ' HB2' ' A' ' 48' ' ' ALA . 2.4 pp0? -68.75 -8.41 42.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 64.11 110.88 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.42 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . . . -95.81 -43.95 7.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 71.55 111.067 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -93.38 -47.83 6.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 45.1 110.848 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.418 HD13 ' CG ' ' A' ' 71' ' ' HIS . 29.5 mt -88.93 -12.48 41.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 55.13 110.922 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 70.59 -0.51 26.51 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.789 -0.72 . . . . 71.43 112.484 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.403 ' O ' ' CB ' ' A' ' 47' ' ' GLN . 32.9 t -47.2 144.76 2.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.824 0.345 . . . . 60.34 110.884 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -125.07 19.29 8.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 72.32 110.895 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.418 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . 32.3 t -66.86 111.64 3.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 72.21 110.862 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -109.98 145.19 37.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 74.31 110.934 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.583 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -137.37 154.93 49.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.22 -0.445 . . . . 62.02 111.029 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.634 HG21 ' HE3' ' A' ' 39' ' ' LYS . 75.7 mt -111.33 135.12 51.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 74.5 111.103 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.6 p -117.84 128.76 55.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 61.55 111.18 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.405 ' CG ' ' HG2' ' A' ' 39' ' ' LYS . 9.8 mt-30 -131.81 95.1 3.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 71.2 110.85 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 87.4 -95.44 2.08 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.74 -0.743 . . . . 65.34 112.502 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -127.09 0.23 6.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.797 0.332 . . . . 72.31 110.882 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.3 mmm-85 -104.18 -179.26 3.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 63.24 110.814 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.817 HD13 ' CG ' ' A' ' 25' ' ' HIS . 17.6 tt -150.3 160.57 4.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 72.4 111.147 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.583 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 4.5 mpp? -137.65 140.99 41.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 71.45 110.896 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 92.6 t -102.7 127.9 56.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 71.43 111.113 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.7 mtm -105.16 -16.59 14.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 74.14 110.865 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -154.49 160.28 41.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.851 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 88.2 p -90.09 179.25 5.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 62.44 110.831 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.486 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 38.4 m-70 -116.5 134.28 55.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.089 -0.505 . . . . 64.54 110.881 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 45.4 t -85.85 4.94 34.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 44.31 110.854 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.418 ' CG ' HD13 ' A' ' 50' ' ' LEU . 28.2 p80 -131.6 163.97 26.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.454 . . . . 74.32 110.869 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -100.82 149.21 35.99 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.617 0.722 . . . . 73.11 110.898 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.49 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 54.3 Cg_endo -69.71 156.47 63.39 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.692 2.261 . . . . 62.15 112.395 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.93 95.69 3.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.233 -0.439 . . . . 71.4 110.885 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mt -57.06 -14.82 4.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 64.32 110.924 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -74.47 -46.26 40.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.249 -0.432 . . . . 63.1 111.148 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.67 -31.57 40.11 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.686 -0.768 . . . . 62.42 112.508 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -70.66 -42.49 70.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.786 0.327 . . . . 64.51 110.964 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -64.56 -35.76 82.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 71.52 110.934 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.37 -37.98 79.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 70.4 111.083 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.3 mt -69.94 -22.58 63.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.272 -0.422 . . . . 75.33 110.916 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.685 ' NH2' HG11 ' A' ' 24' ' ' VAL . 35.7 mtt180 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 72.15 110.891 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.976 HD21 HD11 ' A' ' 23' ' ' LEU . 11.1 tp . . . . . 0 N--CA 1.458 -0.067 0 CA-C-O 120.788 0.328 . . . . 74.44 110.892 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.406 ' CD ' ' NH1' ' A' ' 82' ' ' ARG . 24.8 tt0 -104.51 144.45 31.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 74.32 110.916 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.405 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 20.4 m-85 -140.03 171.92 13.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 65.22 110.85 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.675 HD11 ' CD ' ' A' ' 82' ' ' ARG . 6.2 mt -144.21 155.82 44.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 73.14 110.973 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 72.4 110.822 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.91 0.386 . . . . 74.52 110.822 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -129.26 158.6 38.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 65.35 110.868 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.976 HD11 HD21 ' A' ' 11' ' ' LEU . 11.1 tp -123.18 116.12 22.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 73.34 110.897 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.53 116.19 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 75.12 111.152 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.809 ' CG ' HD13 ' A' ' 63' ' ' ILE . 10.5 t60 -152.29 126.73 9.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 63.31 110.874 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 62.29 42.79 8.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.26 -0.427 . . . . 63.34 110.914 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.7 m 55.22 27.73 10.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.487 . . . . 73.43 110.847 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -125.99 -176.49 3.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 73.44 110.893 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 19.4 mt -135.33 131.99 37.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 72.04 110.895 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.515 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -126.7 168.77 13.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.473 . . . . 75.22 110.968 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.451 ' CZ ' ' HB3' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -127.97 138.92 52.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 54.53 110.888 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.501 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 33.6 tttp -63.2 112.38 2.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 74.14 110.936 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -86.73 -58.39 2.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 72.44 110.921 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.5 pttm -146.88 -177.58 5.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.145 -0.48 . . . . 74.23 110.864 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -144.41 121.83 11.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 75.43 111.184 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.5 51.11 2.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 62.21 111.121 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.94 -59.8 3.05 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.799 -0.715 . . . . 64.22 112.501 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.413 ' N ' ' CD ' ' A' ' 38' ' ' GLU . 13.5 mp0 -112.91 -30.19 7.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.896 0.379 . . . . 75.14 110.861 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.515 ' NZ ' HG21 ' A' ' 57' ' ' ILE . 18.4 mtpp -94.1 153.77 17.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 74.22 110.872 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.2 t -129.24 115.34 35.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.267 -0.424 . . . . 74.34 111.144 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -80.76 144.21 32.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 73.1 110.898 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.501 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 72.0 m95 -135.04 163.22 30.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 74.41 110.902 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.9 ptt? -148.19 131.59 16.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 62.15 110.932 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.0 t -42.31 115.31 0.67 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.289 -0.414 . . . . 65.11 110.812 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 39.4 ptt85 -50.5 -18.96 0.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 73.4 110.886 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.692 ' CB ' HD12 ' A' ' 50' ' ' LEU . 6.2 m-20 -88.26 32.06 0.78 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.461 . . . . 74.43 110.87 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.618 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -84.6 -14.53 48.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 73.0 110.865 -179.891 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.436 ' HB2' ' OE1' ' A' ' 47' ' ' GLN . . . -97.04 -46.3 6.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 61.54 111.133 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.1 ttt180 -84.48 -55.23 4.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.196 -0.456 . . . . 75.34 110.82 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.692 HD12 ' CB ' ' A' ' 46' ' ' ASP . 64.6 mt -88.07 9.56 22.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.289 -0.414 . . . . 74.53 110.957 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.8 35.48 2.18 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.746 -0.74 . . . . 62.52 112.47 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.423 ' N ' ' HA ' ' A' ' 47' ' ' GLN . 32.2 t -78.5 125.52 29.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.787 0.327 . . . . 70.31 110.878 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.65 19.31 18.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 63.14 110.863 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.7 t -69.64 125.67 27.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 64.34 110.855 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -122.48 159.52 27.48 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.164 -0.471 . . . . 54.14 110.91 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.561 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -151.74 149.48 29.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 35.14 111.075 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.515 HG21 ' NZ ' ' A' ' 39' ' ' LYS . 61.4 mt -117.7 131.08 71.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 74.11 111.139 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.639 HG22 HG13 ' A' ' 63' ' ' ILE . 30.1 p -115.66 144.69 43.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 64.24 111.217 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -130.39 94.66 3.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 72.12 110.96 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 78.55 -85.65 1.15 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.78 -0.724 . . . . 60.3 112.489 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -128.07 5.29 5.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.768 0.318 . . . . 55.2 110.854 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -102.8 176.98 4.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.206 -0.452 . . . . 73.22 110.835 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.809 HD13 ' CG ' ' A' ' 25' ' ' HIS . 18.3 tt -150.79 149.82 13.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.126 -0.488 . . . . 74.2 111.115 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.561 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 53.7 mtm -138.27 140.12 39.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 75.12 110.862 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.401 ' CG2' ' NE2' ' A' ' 25' ' ' HIS . 66.8 t -99.43 142.21 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 71.21 111.101 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 29.0 mmm -103.4 -62.25 1.31 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 65.23 110.926 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 -114.99 -175.75 2.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.305 -0.407 . . . . 64.51 110.882 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.7 p -96.91 -175.57 3.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 74.24 110.892 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.453 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 69.5 m-70 -117.74 135.31 54.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 53.42 110.866 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.3 t -90.1 14.94 11.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 63.13 110.927 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.578 ' CG ' HD13 ' A' ' 50' ' ' LEU . 25.2 p80 -143.36 162.29 36.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 75.33 110.829 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -93.59 152.84 41.17 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.645 0.736 . . . . 71.33 110.874 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 154.92 67.18 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.702 2.268 . . . . 72.3 112.375 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.26 82.34 2.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 75.14 110.897 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.1 mt -53.79 -16.32 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 73.04 110.906 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.05 -52.6 13.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 53.02 111.102 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.9 -30.11 64.03 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.666 -0.778 . . . . 65.3 112.442 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.6 tp -73.03 -46.06 54.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.86 0.362 . . . . 64.4 110.922 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.57 -36.51 78.67 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.216 -0.447 . . . . 65.42 110.837 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.47 -32.11 66.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 62.23 111.115 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.6 mt -73.57 -42.69 61.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 74.42 110.903 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.675 ' CD ' HD11 ' A' ' 14' ' ' LEU . 1.6 mpp_? . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 70.41 110.865 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.659 HD21 HD11 ' A' ' 23' ' ' LEU . 11.7 tp . . . . . 0 CA--C 1.526 0.051 0 CA-C-O 120.846 0.355 . . . . 72.23 110.853 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -104.47 136.24 44.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.131 -0.486 . . . . 63.22 110.902 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.438 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 94.4 m-85 -126.85 163.4 23.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 73.24 110.904 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.8 HD12 ' CG2' ' A' ' 24' ' ' VAL . 1.4 mt -148.9 153.31 37.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.136 -0.483 . . . . 71.12 110.893 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 ppt_? . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 73.15 110.84 179.954 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.1 tpp180 . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.738 0.304 . . . . 73.25 110.916 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -99.0 168.93 9.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 73.53 110.914 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.659 HD11 HD21 ' A' ' 11' ' ' LEU . 7.9 tp -123.85 114.13 19.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.112 -0.494 . . . . 72.43 110.894 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.8 ' CG2' HD12 ' A' ' 14' ' ' LEU . 43.0 t -90.74 110.75 22.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.45 . . . . 73.23 111.106 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.95 ' CG ' HD13 ' A' ' 63' ' ' ILE . 32.6 t60 -147.65 125.07 11.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 72.24 110.868 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 63.24 38.41 10.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.243 -0.435 . . . . 70.54 110.863 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.578 ' OG ' HD23 ' A' ' 75' ' ' LEU . 22.2 t 62.6 15.41 7.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 62.33 110.898 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -112.59 177.58 4.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.115 -0.493 . . . . 75.14 110.884 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.444 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 44.6 mt -132.46 129.7 39.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 55.04 110.927 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.499 ' HB2' HD23 ' A' ' 23' ' ' LEU . 1.2 m-85 -124.53 175.4 7.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 73.21 110.897 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 30.0 mtp180 -133.47 139.22 46.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 74.15 110.852 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -64.75 111.14 2.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 73.31 110.93 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -86.96 -57.91 2.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 75.51 110.909 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.75 167.89 27.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 54.13 110.881 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -127.38 131.61 50.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.224 -0.444 . . . . 61.32 111.093 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -117.71 100.05 7.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 62.05 111.129 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.33 -96.44 0.2 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.705 -0.76 . . . . 65.41 112.431 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -113.55 2.34 15.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.91 0.386 . . . . 72.43 110.896 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -105.07 157.6 17.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 75.5 110.847 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.5 t -136.66 116.67 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 44.2 111.137 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -79.09 146.71 33.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 73.51 110.956 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.509 ' CG ' HD22 ' A' ' 23' ' ' LEU . 69.1 m95 -136.51 167.38 21.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 71.31 110.981 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.6 ptt? -152.52 132.64 13.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.427 . . . . 71.04 110.86 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -45.43 113.93 0.67 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.215 -0.448 . . . . 73.44 110.893 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.448 ' NH2' HD11 ' A' ' 81' ' ' LEU . 18.0 ptt180 -54.89 -28.74 52.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 73.4 110.87 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.47 48.19 1.54 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 41.53 110.866 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -84.76 -37.04 21.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 74.13 110.95 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.17 -12.9 29.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 72.22 111.078 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.94 -40.99 7.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 72.53 110.855 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.641 HD13 ' CG ' ' A' ' 71' ' ' HIS . 90.3 mt -114.76 23.99 12.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 71.23 110.886 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.96 53.14 0.86 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.707 -0.759 . . . . 73.51 112.5 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.61 118.45 25.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.86 0.362 . . . . 75.44 110.897 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.8 mmt85 -105.58 50.23 0.78 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 73.33 110.815 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.3 t -87.33 117.26 25.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 74.12 110.806 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -105.15 161.55 14.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.141 -0.481 . . . . 73.44 110.902 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.782 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -148.08 163.01 38.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 64.15 111.059 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 70.2 mt -127.32 127.79 69.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 74.33 111.117 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.644 HG22 HG13 ' A' ' 63' ' ' ILE . 42.1 p -110.94 144.31 40.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 73.32 111.191 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -128.46 90.29 3.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.415 . . . . 74.03 110.995 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.95 -86.73 0.97 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.732 -0.747 . . . . 61.31 112.456 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -124.68 7.87 8.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.771 0.32 . . . . 73.12 110.854 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.443 ' HG3' ' N ' ' A' ' 63' ' ' ILE . 10.3 ptt180 -105.82 180.0 4.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 72.34 110.831 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.95 HD13 ' CG ' ' A' ' 25' ' ' HIS . 17.5 tt -151.0 153.8 9.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 65.4 111.166 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.782 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 30.3 ttp -144.3 147.1 33.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 63.32 110.924 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 t -116.88 145.69 22.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 71.31 111.125 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 2.4 mtt -112.38 -62.31 1.59 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 72.3 110.871 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 -96.32 177.48 5.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.277 -0.42 . . . . 63.44 110.836 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.7 m -100.64 174.02 6.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 65.42 110.819 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.411 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 74.4 m-70 -107.88 127.69 53.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 73.21 110.85 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 8.2 t -82.53 14.74 2.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 73.42 110.897 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.641 ' CG ' HD13 ' A' ' 50' ' ' LEU . 27.8 p80 -145.12 153.12 41.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 75.04 110.842 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -86.8 152.49 54.01 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.621 0.724 . . . . 64.42 110.89 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 152.85 69.54 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.676 2.251 . . . . 60.13 112.377 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.55 90.95 3.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 52.04 110.878 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.578 HD23 ' OG ' ' A' ' 27' ' ' SER . 18.8 mt -58.69 -31.13 67.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 54.2 110.92 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -68.58 -31.97 71.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 63.21 111.153 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -88.54 -37.5 7.48 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.675 -0.774 . . . . 43.34 112.534 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.585 HD11 HG13 ' A' ' 24' ' ' VAL . 10.2 tp -72.6 -40.09 66.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.722 0.296 . . . . 72.13 110.892 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.567 ' N ' HH21 ' A' ' 82' ' ' ARG . 30.8 mm-40 -64.22 -30.35 71.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 63.22 110.867 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.12 -59.53 4.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 44.0 111.095 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.448 HD11 ' NH2' ' A' ' 45' ' ' ARG . 14.4 mt -39.47 -43.46 1.25 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 74.42 110.97 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.567 HH21 ' N ' ' A' ' 79' ' ' GLU . 55.6 mtm180 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.101 -0.5 . . . . 74.24 110.878 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.869 HD21 HD11 ' A' ' 23' ' ' LEU . 25.9 tp . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.816 0.341 . . . . 63.55 110.933 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.511 ' OE2' HG21 ' A' ' 24' ' ' VAL . 21.6 tt0 -102.32 150.0 23.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 73.34 110.908 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.436 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 37.1 m-85 -139.42 172.05 13.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.114 -0.494 . . . . 74.42 110.914 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.424 HD12 HD21 ' A' ' 29' ' ' LEU . 10.9 mt -144.45 151.78 39.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 73.04 110.94 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.4 ' HG2' ' CD ' ' A' ' 21' ' ' ARG . 79.1 mtm-85 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.269 -0.423 . . . . 74.13 110.866 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.4 ' CD ' ' HG2' ' A' ' 15' ' ' ARG . 11.6 tpt180 . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.924 0.392 . . . . 74.24 110.842 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.434 ' HB3' HD22 ' A' ' 29' ' ' LEU . 2.7 m-85 -107.45 158.79 16.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 65.41 110.875 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.869 HD11 HD21 ' A' ' 11' ' ' LEU . 8.9 tp -125.1 114.64 19.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.16 -0.473 . . . . 73.35 110.91 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.511 HG21 ' OE2' ' A' ' 12' ' ' GLU . 53.5 t -87.96 119.46 35.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 74.15 111.124 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.915 ' CG ' HD13 ' A' ' 63' ' ' ILE . 25.2 t60 -156.45 126.17 6.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.247 -0.433 . . . . 71.44 110.937 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 61.53 41.07 12.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.234 -0.439 . . . . 75.03 110.87 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.413 ' HB2' ' CB ' ' A' ' 73' ' ' PRO . 10.3 m 58.37 32.44 22.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.091 -0.504 . . . . 74.31 110.858 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -131.41 -175.48 3.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 65.01 110.938 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.449 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 29.3 mt -140.63 133.23 28.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 74.3 110.886 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.51 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.1 m-85 -127.89 162.64 26.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 70.25 110.915 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.5 mtp180 -120.74 136.16 54.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 75.23 110.897 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.552 ' NZ ' ' HB2' ' A' ' 35' ' ' ALA . 38.5 tttp -58.66 112.07 1.49 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 62.43 110.97 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.44 ' OE1' ' NH2' ' A' ' 55' ' ' ARG . 1.6 tm-20 -82.87 -51.22 7.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.431 . . . . 73.1 110.937 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.57 ' HD3' ' CD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -158.52 179.12 9.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 74.34 110.898 179.935 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.552 ' HB2' ' NZ ' ' A' ' 32' ' ' LYS . . . -130.78 135.31 47.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 63.0 111.098 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -118.76 -172.58 2.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 51.01 111.111 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.25 92.12 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 74.24 112.478 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 66.71 43.24 2.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.917 0.389 . . . . 44.22 110.914 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -154.26 159.18 41.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 71.34 110.882 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.3 t -135.78 121.01 28.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 64.45 111.096 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.57 ' CD1' ' HD3' ' A' ' 34' ' ' LYS . 8.9 m-85 -85.39 149.12 25.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 75.23 110.914 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.437 ' CD1' HG23 ' A' ' 58' ' ' THR . 70.0 m95 -143.0 149.76 38.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 73.5 110.914 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -135.36 130.83 35.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 71.15 110.913 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.432 ' O ' ' N ' ' A' ' 46' ' ' ASP . 2.2 t -46.59 107.56 0.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 73.13 110.861 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.449 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.7 ptt-85 -40.23 -27.28 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 72.2 110.843 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 44' ' ' CYS . 0.3 OUTLIER -88.8 40.52 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 71.24 110.845 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -86.43 -37.46 18.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 73.52 110.909 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.62 -15.08 23.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 74.33 111.079 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.8 tpp180 -92.41 -61.93 1.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 63.34 110.89 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.1 mt -103.54 29.17 5.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 52.55 110.954 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.59 47.31 4.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.757 -0.735 . . . . 42.33 112.501 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.2 t -105.5 72.86 0.99 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.893 0.378 . . . . 65.33 110.931 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.474 ' HD3' ' N ' ' A' ' 54' ' ' SER . 0.0 OUTLIER -55.88 -13.88 2.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.12 -0.491 . . . . 75.4 110.828 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.474 ' N ' ' HD3' ' A' ' 53' ' ' ARG . 3.4 t -35.55 122.72 0.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 54.45 110.89 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.44 ' NH2' ' OE1' ' A' ' 33' ' ' GLU . 37.5 mtp180 -118.71 177.06 4.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 71.5 110.876 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.413 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -161.62 151.4 16.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 53.52 111.091 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.794 HD12 ' CE ' ' A' ' 66' ' ' MET . 61.7 mt -121.84 133.63 67.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 73.1 111.098 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.562 HG22 HG13 ' A' ' 63' ' ' ILE . 22.7 p -116.01 144.39 44.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 71.43 111.146 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -126.79 88.94 2.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 74.23 110.928 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 81.55 -86.92 1.39 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.711 -0.757 . . . . 72.33 112.417 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -126.03 8.12 7.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.752 0.31 . . . . 71.44 110.845 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.411 ' HG3' ' N ' ' A' ' 63' ' ' ILE . 8.2 ptm180 -106.42 179.82 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 71.11 110.867 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.915 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.95 151.73 12.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 65.24 111.162 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.433 ' N ' ' O ' ' A' ' 57' ' ' ILE . 3.9 mpp? -140.91 140.11 34.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 64.51 110.904 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.5 t -109.8 140.25 29.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 61.3 111.085 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.794 ' CE ' HD12 ' A' ' 57' ' ' ILE . 6.8 mmt -104.0 -53.78 2.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.153 -0.476 . . . . 73.21 110.864 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.3 mtp85 -115.05 167.67 10.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 74.41 110.93 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.0 m -86.54 -175.76 5.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 74.1 110.848 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 63.6 m-70 -118.85 137.3 53.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.17 -0.468 . . . . 64.5 110.841 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 16.6 t -91.29 9.99 29.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 51.2 110.786 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 33.0 p80 -138.23 157.3 46.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 75.33 110.916 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -89.96 156.49 46.81 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.599 0.714 . . . . 52.24 110.898 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.413 ' CB ' ' HB2' ' A' ' 27' ' ' SER . 54.0 Cg_endo -69.7 140.19 42.31 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.727 2.285 . . . . 61.34 112.335 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -102.53 80.95 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 71.03 110.903 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 57.2 mt -53.78 -16.47 1.74 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 62.34 110.963 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.22 -57.65 2.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.441 . . . . 53.04 111.073 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.79 -33.67 83.89 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.726 -0.749 . . . . 74.13 112.453 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.9 tp -70.53 -49.52 47.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.784 0.326 . . . . 75.42 110.936 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -62.24 -31.75 72.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 63.11 110.844 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.61 -54.57 22.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 73.1 111.063 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 15.8 mt -56.19 -32.39 64.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 60.44 110.928 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 6.5 mtp-105 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 75.22 110.917 179.91 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.908 HD21 HD11 ' A' ' 23' ' ' LEU . 22.6 tp . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.733 0.301 . . . . 60.22 110.925 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.468 ' C ' ' CD1' ' A' ' 13' ' ' PHE . 4.8 tp10 -118.57 150.03 40.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 72.14 110.881 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.756 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 1.9 m-85 -139.97 168.05 20.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 74.03 110.865 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.687 HD21 ' HG2' ' A' ' 82' ' ' ARG . 8.6 mt -135.26 117.24 15.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.17 -0.468 . . . . 72.41 110.896 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.3 ttt-85 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 55.45 110.842 179.974 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 tpp85 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.856 0.36 . . . . 74.34 110.848 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -116.01 160.59 20.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 63.24 110.833 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.908 HD11 HD21 ' A' ' 11' ' ' LEU . 8.1 tp -122.63 113.89 19.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.065 -0.516 . . . . 73.22 110.908 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 88.8 t -88.6 117.57 32.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 73.53 111.115 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.77 ' CG ' HD13 ' A' ' 63' ' ' ILE . 8.4 t60 -153.22 124.88 7.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 70.3 110.889 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 62.17 45.3 7.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.278 -0.419 . . . . 32.22 110.909 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 53.61 21.95 2.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.139 -0.482 . . . . 70.24 110.831 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -119.57 -179.95 4.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 63.43 110.902 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' C ' ' CD1' ' A' ' 30' ' ' TYR . 43.6 mt -129.91 136.99 50.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 74.32 110.924 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.519 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -133.6 167.06 21.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 73.42 110.936 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.8 mtp180 -130.34 138.27 50.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 72.42 110.874 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 31.4 tttm -57.12 119.92 7.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.219 -0.446 . . . . 74.13 110.897 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -95.83 -55.09 3.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.282 -0.417 . . . . 74.14 110.876 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 45.5 pttt -151.13 178.68 8.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.107 -0.497 . . . . 75.33 110.864 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.02 121.21 15.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 54.11 111.19 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.4 56.74 3.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 63.14 111.094 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.31 -65.75 3.77 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.739 -0.743 . . . . 60.32 112.492 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -117.37 -20.87 8.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.883 0.373 . . . . 72.04 110.87 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.4 mtmm -93.4 161.32 14.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 75.04 110.937 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 t -137.03 116.12 15.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.29 -0.414 . . . . 74.21 111.12 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.435 ' CE2' HD11 ' A' ' 57' ' ' ILE . 6.3 m-85 -81.67 149.78 28.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 65.02 110.929 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.61 ' CG ' HD22 ' A' ' 23' ' ' LEU . 62.9 m95 -138.75 158.59 43.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.102 -0.499 . . . . 64.42 110.857 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 7.0 ptt? -142.24 137.97 31.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 73.31 110.867 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.41 ' C ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -46.42 108.39 0.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 74.4 110.906 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -44.4 -22.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 71.13 110.848 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.41 ' N ' ' C ' ' A' ' 44' ' ' CYS . 0.5 OUTLIER -84.09 35.79 0.54 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.438 . . . . 70.42 110.904 179.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -48.27 -65.28 0.59 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.182 -0.463 . . . . 54.35 110.941 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -92.56 -33.07 14.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.226 -0.443 . . . . 73.13 111.096 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.75 -46.2 70.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.235 -0.439 . . . . 61.21 110.928 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 58.7 mt -123.69 25.93 7.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 63.5 110.872 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 39.36 43.94 2.16 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.694 -0.765 . . . . 64.35 112.529 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.4 t -96.89 148.24 23.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.35 . . . . 74.32 110.854 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.79 33.91 3.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.182 -0.463 . . . . 73.24 110.902 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.41 ' HG ' ' CD2' ' A' ' 69' ' ' HIS . 32.5 t -84.9 118.18 24.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 73.43 110.854 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -112.29 146.55 38.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 64.42 110.837 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.652 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -137.41 157.33 46.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 64.2 111.139 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.435 HD11 ' CE2' ' A' ' 41' ' ' TYR . 84.7 mt -123.18 126.16 73.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 51.52 111.074 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.507 HG23 ' CD1' ' A' ' 42' ' ' TRP . 43.0 p -102.02 152.15 21.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 62.52 111.131 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.8 tm0? -154.61 108.03 2.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 73.45 110.87 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.02 -97.35 0.92 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.774 -0.727 . . . . 72.14 112.571 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -128.77 11.25 6.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.812 0.339 . . . . 74.55 110.81 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -117.63 176.4 5.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 75.33 110.863 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.77 HD13 ' CG ' ' A' ' 25' ' ' HIS . 21.2 tt -143.92 159.43 16.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 62.43 111.147 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.652 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 5.6 ttp -135.72 148.97 49.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 75.12 110.914 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.6 t -120.13 142.61 35.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 43.53 111.139 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.4 mtp -117.73 -63.48 1.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 62.2 110.888 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -89.61 171.24 9.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 74.32 110.809 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -103.44 174.04 6.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.102 -0.499 . . . . 73.12 110.841 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.458 ' CE1' ' HH ' ' A' ' 30' ' ' TYR . 62.2 m-70 -110.09 132.66 53.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.49 . . . . 72.12 110.837 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 2.1 t -90.26 13.87 14.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 44.52 110.896 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -140.33 156.9 46.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 62.24 110.816 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -92.49 155.3 42.37 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 121.565 0.697 . . . . 51.42 110.883 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 162.23 42.87 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.659 2.239 . . . . 74.25 112.327 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.36 79.93 1.73 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 74.43 110.829 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.0 mt -46.35 -23.24 0.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 71.22 110.955 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.59 -40.93 72.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 45.13 111.111 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -80.44 -40.5 12.94 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.754 -0.736 . . . . 64.31 112.48 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.1 tp -65.77 -39.63 91.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.78 0.324 . . . . 54.14 110.909 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -63.64 -31.95 73.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 74.51 110.9 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.67 -31.57 72.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.491 . . . . 75.34 111.097 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.8 mt -79.35 -28.26 42.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 73.22 110.934 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.687 ' HG2' HD21 ' A' ' 14' ' ' LEU . 69.5 mtp180 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 74.45 110.84 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.95 HD21 HD11 ' A' ' 23' ' ' LEU . 20.7 tp . . . . . 0 CA--C 1.526 0.037 0 CA-C-O 120.833 0.349 . . . . 72.21 110.877 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -107.31 151.67 25.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 65.01 110.849 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.613 ' CE2' HD13 ' A' ' 23' ' ' LEU . 72.1 m-85 -137.22 172.96 12.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.121 -0.49 . . . . 75.45 110.83 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.493 HD12 HD21 ' A' ' 29' ' ' LEU . 16.6 mt -147.81 174.1 12.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.088 -0.506 . . . . 75.45 110.937 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 62.35 110.816 179.94 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.407 ' CD ' ' O ' ' A' ' 14' ' ' LEU . 12.1 tpt180 . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.786 0.327 . . . . 54.22 110.916 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -107.42 158.67 16.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 62.43 110.936 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.95 HD11 HD21 ' A' ' 11' ' ' LEU . 13.1 tp -124.11 115.96 22.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.466 . . . . 74.21 110.935 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.3 t -90.35 115.51 29.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 64.01 111.086 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.877 ' CG ' HD13 ' A' ' 63' ' ' ILE . 29.7 t60 -153.49 132.77 12.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 74.31 110.809 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 60.02 33.16 21.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 75.44 110.967 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.8 m 65.43 29.23 11.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.119 -0.491 . . . . 52.54 110.909 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -130.74 -174.68 3.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.109 -0.496 . . . . 63.52 110.848 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.493 HD21 HD12 ' A' ' 14' ' ' LEU . 9.8 mt -138.86 132.7 30.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.108 -0.496 . . . . 74.05 110.967 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.522 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -125.96 166.92 16.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.19 -0.459 . . . . 75.1 110.973 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -126.29 126.42 43.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.132 -0.486 . . . . 73.01 110.843 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -45.18 108.58 0.13 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.151 -0.477 . . . . 45.41 110.878 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -82.89 -53.41 5.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 71.3 110.927 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.466 ' HD3' ' CD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -159.16 178.8 9.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.083 -0.508 . . . . 74.31 110.923 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -130.52 128.61 41.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.446 . . . . 63.54 111.068 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.41 19.91 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 75.14 111.07 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 90.86 -49.65 3.1 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.731 -0.747 . . . . 51.23 112.472 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -111.32 -18.83 12.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.922 0.391 . . . . 71.21 110.866 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.464 ' HB3' ' CG2' ' A' ' 57' ' ' ILE . 9.9 mtmm -123.02 170.64 9.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.236 -0.438 . . . . 73.54 110.938 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.441 ' O ' ' CD1' ' A' ' 42' ' ' TRP . 4.7 t -133.53 119.13 33.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.236 -0.438 . . . . 65.53 111.114 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.466 ' CD1' ' HD3' ' A' ' 34' ' ' LYS . 2.9 m-85 -75.79 150.3 37.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.113 -0.494 . . . . 74.42 110.922 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.734 ' CD1' HG23 ' A' ' 58' ' ' THR . 75.3 m95 -142.92 121.96 12.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.106 -0.497 . . . . 64.3 110.892 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -106.26 136.06 46.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.239 -0.437 . . . . 44.25 110.877 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.6 t -50.4 113.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 74.14 110.924 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.43 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 20.7 ptt-85 -44.66 -35.16 2.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 74.23 110.927 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.69 44.31 0.62 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 74.42 110.902 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -88.77 -26.18 21.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 75.44 110.914 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.77 -30.72 12.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 55.31 111.106 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.442 ' CZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.5 ttp-105 -89.04 -62.34 1.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 70.04 110.855 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.5 mt -90.37 20.31 4.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 62.21 110.867 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 36.72 36.88 0.19 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.721 -0.752 . . . . 44.12 112.512 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.7 t -89.33 120.67 30.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.791 0.329 . . . . 74.44 110.877 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 40.8 mmm-85 -98.75 13.75 31.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.456 . . . . 73.23 110.857 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.507 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 23.2 t -61.26 108.21 0.88 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 74.54 110.94 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.43 ' CB ' ' CZ ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -111.08 164.33 12.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 70.01 110.868 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.735 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -157.23 159.93 38.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.42 111.13 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.464 ' CG2' ' HB3' ' A' ' 39' ' ' LYS . 74.6 mt -123.98 128.49 74.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.234 -0.439 . . . . 72.31 111.16 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.734 HG23 ' CD1' ' A' ' 42' ' ' TRP . 30.0 p -101.29 144.21 30.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 54.34 111.14 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.56 111.02 6.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 73.43 110.88 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 68.73 -94.77 0.36 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.717 -0.754 . . . . 64.32 112.505 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.68 7.28 5.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.832 0.348 . . . . 75.13 110.894 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -112.41 178.82 4.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 64.11 110.872 -179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.877 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.2 tt -145.74 157.87 12.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 73.24 111.172 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.735 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 2.7 ttp -135.31 140.66 45.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 54.05 110.804 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.1 t -106.37 143.22 17.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 62.13 111.162 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.0 mtp -117.96 -55.21 2.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 74.44 110.897 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -110.75 144.91 38.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 74.31 110.828 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.3 p -75.39 168.71 19.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 74.44 110.783 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.507 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 72.6 m-70 -104.5 132.75 50.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.5 . . . . 74.05 110.833 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.6 t -86.21 11.95 10.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 55.43 110.853 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 25.9 p80 -140.2 154.96 47.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 74.45 110.858 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -89.52 152.36 47.17 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.67 0.747 . . . . 72.54 110.878 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 159.58 52.86 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.665 2.243 . . . . 71.22 112.365 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.48 85.68 2.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 44.22 110.892 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.2 mt -52.34 -18.17 1.48 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 65.42 110.918 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.6 -52.28 13.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 73.51 111.099 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -70.98 -34.96 64.94 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.666 -0.778 . . . . 21.24 112.571 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.1 tp -68.55 -42.04 78.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.802 0.334 . . . . 73.33 110.937 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.57 -40.81 97.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 64.32 110.891 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.95 -28.45 57.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.24 111.102 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.2 mt -81.59 -29.65 33.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.4 110.943 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 41.4 mtp180 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 61.42 110.901 179.89 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.758 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 23.7 tp . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.817 0.342 . . . . 73.4 110.909 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -91.66 136.71 32.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 71.33 110.857 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.758 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 68.3 m-85 -136.82 169.65 17.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 73.43 110.898 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.418 HD21 ' HG2' ' A' ' 82' ' ' ARG . 12.8 mt -143.92 120.99 11.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 64.3 110.931 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 62.41 110.881 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 ttp180 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.798 0.333 . . . . 74.03 110.852 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -129.25 166.04 20.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 74.23 110.88 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.636 HD11 HD21 ' A' ' 11' ' ' LEU . 5.0 tp -133.18 113.42 12.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.171 -0.468 . . . . 52.54 110.91 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.4 t -88.06 119.53 35.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 65.24 111.164 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.646 ' CG ' HD13 ' A' ' 63' ' ' ILE . 4.7 t60 -155.85 132.38 10.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 75.32 110.821 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 58.19 36.72 26.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.282 -0.417 . . . . 64.5 110.851 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m 62.23 26.07 15.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 53.25 110.822 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -126.29 -178.63 4.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 74.04 110.923 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.528 ' CD1' ' CZ ' ' A' ' 45' ' ' ARG . 67.8 mt -132.75 136.19 46.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.477 . . . . 72.42 110.926 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -130.46 159.46 36.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 70.21 110.878 -179.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.458 ' NE ' ' HA ' ' A' ' 45' ' ' ARG . 3.0 mtt180 -113.96 136.81 52.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 75.44 110.881 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.4 tttt -61.28 108.67 0.96 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 64.52 110.892 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -81.01 -60.06 2.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.278 -0.419 . . . . 71.11 110.89 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 26.8 pttt -153.0 177.71 10.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 74.54 110.888 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -138.49 117.57 12.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.441 . . . . 64.12 111.134 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.8 91.75 4.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 34.12 111.142 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.25 -85.84 0.1 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.73 -0.748 . . . . 74.23 112.539 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -117.26 0.17 12.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.91 0.386 . . . . 74.13 110.879 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.623 ' HE3' HG21 ' A' ' 57' ' ' ILE . 55.8 mtpt -102.94 156.77 17.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 74.44 110.893 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.5 t -138.25 117.6 14.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.267 -0.424 . . . . 42.04 111.126 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.786 ' CE2' HD11 ' A' ' 57' ' ' ILE . 9.1 m-85 -82.07 146.64 29.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 74.15 110.952 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.559 ' CG ' HD22 ' A' ' 23' ' ' LEU . 71.8 m95 -137.3 159.64 41.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.13 -0.486 . . . . 75.22 110.904 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.1 ptt? -143.64 126.13 15.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 72.31 110.908 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -38.16 114.11 0.33 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.271 -0.422 . . . . 62.32 110.871 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.528 ' CZ ' ' CD1' ' A' ' 29' ' ' LEU . 20.2 ptt180 -52.64 -22.57 5.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 71.04 110.864 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.56 43.32 1.02 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 72.42 110.867 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -85.86 -35.51 20.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.456 . . . . 72.33 110.885 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.6 -9.3 27.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 45.15 111.103 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 ttm-85 -98.29 -54.7 2.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 74.24 110.864 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.3 mt -110.05 26.46 10.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 71.24 110.886 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.14 47.38 4.33 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.757 -0.735 . . . . 64.42 112.494 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.1 t -94.94 147.08 23.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.747 0.308 . . . . 72.14 110.918 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.406 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -132.07 26.65 4.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 74.44 110.857 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.684 ' HG ' ' CE1' ' A' ' 69' ' ' HIS . 47.0 t -78.07 109.53 12.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 73.51 110.828 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.406 ' NH1' ' HB2' ' A' ' 53' ' ' ARG . 9.7 mpt_? -103.75 158.29 16.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.33 110.915 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -149.13 161.39 42.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 75.44 111.064 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.786 HD11 ' CE2' ' A' ' 41' ' ' TYR . 40.6 mt -127.19 121.57 57.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 55.01 111.12 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.5 p -102.58 143.71 31.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.49 . . . . 73.13 111.127 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -129.25 87.05 2.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.243 -0.435 . . . . 70.21 110.944 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.81 -82.26 1.09 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.742 -0.742 . . . . 73.04 112.509 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -127.75 9.59 6.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.709 0.29 . . . . 65.41 110.794 -179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -111.68 170.49 8.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.169 -0.468 . . . . 63.03 110.896 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.646 HD13 ' CG ' ' A' ' 25' ' ' HIS . 5.7 tt -148.13 145.46 18.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 72.21 111.139 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.49 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 4.0 mpp? -132.7 133.31 43.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 71.33 110.897 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.2 t -104.45 130.0 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.416 . . . . 73.23 111.082 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.443 ' CE ' HD12 ' A' ' 57' ' ' ILE . 10.4 mmt -102.46 -62.82 1.22 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 61.3 110.858 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.21 172.93 8.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.272 -0.422 . . . . 72.41 110.842 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -106.24 168.07 9.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 53.0 110.919 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.684 ' CE1' ' HG ' ' A' ' 54' ' ' SER . 48.0 m-70 -105.19 130.98 53.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 72.32 110.899 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.9 t -88.51 11.93 15.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.208 -0.451 . . . . 41.54 110.877 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -137.48 161.0 37.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 63.21 110.827 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -97.22 151.95 37.99 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.55 0.691 . . . . 75.41 110.963 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 154.08 68.29 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.699 2.266 . . . . 61.51 112.369 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -131.36 79.67 1.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.182 -0.463 . . . . 72.01 110.845 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.6 mt -44.18 -23.43 0.1 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.868 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.99 -47.82 67.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.451 . . . . 61.14 111.138 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.52 -35.58 59.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.704 -0.76 . . . . 73.04 112.548 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -71.01 -35.35 72.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.727 0.299 . . . . 62.13 110.906 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -74.6 -25.05 59.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 75.41 110.879 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.93 -31.09 69.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 74.44 111.087 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.0 mt -86.39 -32.05 21.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.266 -0.424 . . . . 54.02 110.92 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.418 ' HG2' HD21 ' A' ' 14' ' ' LEU . 3.6 mtp-105 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 75.44 110.813 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.62 HD21 HD11 ' A' ' 23' ' ' LEU . 14.0 tp . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.755 0.312 . . . . 40.11 110.95 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.593 ' OE2' HG11 ' A' ' 24' ' ' VAL . 31.8 tt0 -90.5 139.94 30.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 61.22 110.883 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.482 ' CZ ' ' HB3' ' A' ' 11' ' ' LEU . 68.7 m-85 -138.88 169.53 17.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.13 -0.487 . . . . 71.42 110.817 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.851 HD21 ' HG3' ' A' ' 82' ' ' ARG . 14.8 mt -142.3 162.01 36.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 71.13 110.873 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 45.4 mtp180 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 73.44 110.911 179.938 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.7 ttm180 . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.897 0.38 . . . . 70.55 110.849 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -116.88 157.8 25.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 75.12 110.841 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.62 HD11 HD21 ' A' ' 11' ' ' LEU . 13.6 tp -120.84 117.08 26.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 75.24 110.853 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.593 HG11 ' OE2' ' A' ' 12' ' ' GLU . 93.7 t -92.31 117.33 35.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 61.21 111.132 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.687 ' CG ' HD13 ' A' ' 63' ' ' ILE . 5.7 t60 -153.52 127.76 9.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.462 . . . . 74.55 110.828 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 61.23 41.63 13.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 74.2 110.884 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.4 m 54.84 35.56 24.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 60.31 110.848 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.412 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 19.1 m-85 -133.03 -176.76 4.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 62.41 110.91 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.619 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 56.5 mt -133.66 132.66 40.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 63.13 110.951 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.517 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -128.43 169.06 14.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 74.45 110.921 -179.925 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.46 ' CZ ' ' HB3' ' A' ' 31' ' ' ARG . 2.1 mtp-105 -129.69 142.99 50.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 73.35 110.889 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -64.13 109.02 1.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 75.11 110.903 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -83.06 -55.08 4.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 60.13 110.853 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.0 pttt -153.36 -176.13 5.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 62.03 110.927 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.75 128.05 22.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 74.1 111.129 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' A' ' 38' ' ' GLU . . . -114.07 -177.12 3.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 63.34 111.053 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -42.7 95.31 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.678 -0.772 . . . . 35.15 112.449 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 36' ' ' ALA . 7.0 mp0 55.6 42.65 29.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.94 0.4 . . . . 74.1 110.873 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.527 ' HD2' HG21 ' A' ' 57' ' ' ILE . 39.6 mtmt -150.12 160.68 43.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.218 -0.446 . . . . 62.42 110.833 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.5 t -138.94 121.0 17.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 62.14 111.133 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -85.3 139.42 31.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 75.1 110.903 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.545 ' CG ' HD22 ' A' ' 23' ' ' LEU . 74.1 m95 -129.55 157.04 43.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.131 -0.486 . . . . 74.33 110.924 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 20.3 ptt? -144.07 136.25 26.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 72.41 110.819 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.4 t -46.39 114.95 0.9 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 61.42 110.832 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.619 ' CZ ' HD13 ' A' ' 29' ' ' LEU . 19.0 ptt180 -55.18 -21.43 13.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.118 -0.492 . . . . 72.51 110.883 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.33 36.6 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 74.02 110.892 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -80.54 -36.45 33.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 71.14 110.927 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.43 -15.33 25.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.185 -0.461 . . . . 64.4 111.046 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.5 ttm180 -98.79 -62.12 1.28 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 73.01 110.806 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.437 HD13 ' CG ' ' A' ' 71' ' ' HIS . 95.4 mt -97.28 26.84 4.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 72.3 110.939 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.02 47.72 1.03 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.753 -0.736 . . . . 70.23 112.538 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 7.6 t -95.65 148.96 21.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.771 0.32 . . . . 74.12 110.895 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 27.7 mmm180 -124.83 8.25 8.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 75.44 110.937 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.462 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 22.8 t -58.36 147.13 32.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 50.41 110.845 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 46.9 mtt180 -146.98 164.2 33.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 72.13 110.862 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.675 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -152.43 153.81 34.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 73.02 111.149 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.527 HG21 ' HD2' ' A' ' 39' ' ' LYS . 85.8 mt -119.25 126.22 75.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.23 -0.441 . . . . 62.33 111.058 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.544 HG22 HG13 ' A' ' 63' ' ' ILE . 49.7 p -103.05 144.69 30.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 72.1 111.144 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -133.81 87.11 2.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 73.35 110.925 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.9 -86.62 1.55 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 63.24 112.472 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -128.11 -5.59 5.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.75 0.31 . . . . 72.12 110.832 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.1 mtm105 -96.4 -178.32 4.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 73.21 110.885 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.687 HD13 ' CG ' ' A' ' 25' ' ' HIS . 8.5 tt -150.63 156.44 6.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 74.43 111.156 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.675 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 1.6 ttp -143.26 144.78 32.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 72.5 110.892 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 86.3 t -102.08 148.64 7.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.227 -0.442 . . . . 74.03 111.14 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 19.1 mtm -119.23 -62.15 1.55 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 71.11 110.899 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.9 mtt85 -103.11 164.31 11.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 72.3 110.921 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.2 m -90.86 175.34 7.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 75.25 110.903 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.462 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 65.1 m-70 -112.88 134.6 54.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 73.11 110.895 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.6 m -92.0 13.42 18.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.465 . . . . 53.21 110.956 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.437 ' CG ' HD13 ' A' ' 50' ' ' LEU . 31.0 p80 -139.67 166.3 24.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.133 -0.485 . . . . 75.13 110.876 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -95.66 153.72 39.34 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.635 0.731 . . . . 71.44 110.963 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.412 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.74 152.7 69.48 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.73 2.286 . . . . 71.25 112.312 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -114.37 75.67 0.94 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 74.45 110.912 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.6 mt -49.56 -19.76 0.64 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.242 -0.435 . . . . 71.31 110.927 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.02 -50.01 6.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 50.14 111.073 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.76 -34.01 88.78 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.744 -0.741 . . . . 64.43 112.472 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -73.65 -44.49 56.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.823 0.344 . . . . 74.41 111.0 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.64 -26.76 68.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 71.53 110.875 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.82 -55.57 14.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 72.5 111.129 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.5 mt -46.51 -49.32 18.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 54.33 110.946 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.851 ' HG3' HD21 ' A' ' 14' ' ' LEU . 9.1 mtt-85 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 74.32 110.881 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.807 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 18.0 tp . . . . . 0 C--O 1.23 0.06 0 CA-C-O 120.837 0.351 . . . . 71.25 110.875 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -110.89 140.44 45.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.158 -0.474 . . . . 72.35 110.899 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.807 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 8.6 m-85 -137.33 172.96 12.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.474 . . . . 72.31 110.89 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.907 HD21 ' HG3' ' A' ' 82' ' ' ARG . 3.7 mt -148.04 160.23 43.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.19 -0.459 . . . . 75.15 110.906 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 65.21 110.848 179.991 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.784 0.326 . . . . 62.23 110.892 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -123.95 160.89 26.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 74.21 110.928 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.796 HD11 HD21 ' A' ' 11' ' ' LEU . 10.9 tp -122.56 118.69 28.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.205 -0.452 . . . . 72.14 110.918 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.684 ' CG2' HD12 ' A' ' 14' ' ' LEU . 24.2 t -94.79 108.22 20.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 63.45 111.166 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.832 ' CG ' HD13 ' A' ' 63' ' ' ILE . 50.1 t60 -145.12 134.14 22.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 73.3 110.86 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 59.54 33.18 22.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 71.14 110.94 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.1 m 65.3 25.39 12.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 75.34 110.854 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.497 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 15.4 m-85 -127.84 179.18 5.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 72.24 110.875 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.485 HD11 HD12 ' A' ' 81' ' ' LEU . 11.2 mt -128.37 133.14 48.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.144 -0.48 . . . . 64.51 110.931 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.505 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.1 m-85 -124.57 164.19 20.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.244 -0.435 . . . . 75.04 110.906 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.2 mtp180 -123.23 134.34 54.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 74.13 110.85 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 34.4 tttm -59.93 110.02 1.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 72.44 110.84 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -85.0 -54.08 4.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 73.32 110.916 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.415 ' CG ' ' HB2' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -146.55 171.26 15.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 72.5 110.881 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -133.39 115.01 14.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 64.03 111.125 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.408 ' O ' ' C ' ' A' ' 37' ' ' GLY . . . -89.14 -175.62 4.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 51.04 111.159 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.408 ' C ' ' O ' ' A' ' 36' ' ' ALA . . . -37.59 -72.48 0.17 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.761 -0.733 . . . . 24.15 112.444 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -125.76 39.78 3.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.945 0.402 . . . . 75.44 110.933 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.66 ' HE3' HG21 ' A' ' 57' ' ' ILE . 40.9 mtpt -145.21 167.9 21.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 71.04 110.89 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 t -138.38 126.15 28.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 71.11 111.08 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.415 ' HB2' ' CG ' ' A' ' 34' ' ' LYS . 2.7 m-85 -90.49 139.56 30.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 71.32 110.967 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -132.99 167.59 20.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 74.33 110.894 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -152.47 130.72 12.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 72.31 110.912 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.404 ' C ' ' N ' ' A' ' 46' ' ' ASP . 2.0 t -44.35 106.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 74.43 110.869 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.5 ptt85 -44.05 -23.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 73.54 110.839 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.404 ' N ' ' C ' ' A' ' 44' ' ' CYS . 2.0 m-20 -85.31 31.31 0.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 74.13 110.834 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.406 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 3.9 tm0? -82.85 -23.63 33.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 73.25 110.921 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.62 -25.84 14.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 55.22 111.081 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.36 -52.8 3.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 73.54 110.806 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.438 HD13 ' CG ' ' A' ' 71' ' ' HIS . 54.3 mt -94.39 9.43 38.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 74.4 110.91 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 46.88 32.65 6.17 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.688 -0.768 . . . . 50.3 112.537 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 36.4 t -80.7 122.23 26.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.8 0.333 . . . . 62.42 110.88 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 26.1 mmm180 -101.5 37.21 1.85 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 74.33 110.869 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.473 ' HG ' ' CD2' ' A' ' 69' ' ' HIS . 13.1 t -88.77 119.65 29.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 73.54 110.862 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -117.02 146.92 42.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 72.13 110.88 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.639 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -139.4 164.85 28.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 54.23 111.029 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.66 HG21 ' HE3' ' A' ' 39' ' ' LYS . 61.4 mt -132.0 117.39 33.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.245 -0.434 . . . . 75.53 111.174 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.583 HG22 HG13 ' A' ' 63' ' ' ILE . 23.7 p -102.73 144.55 30.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 73.0 111.168 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.72 109.12 3.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 71.2 110.901 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.23 -102.86 2.65 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.818 -0.706 . . . . 64.41 112.505 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -127.51 4.78 6.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.723 0.297 . . . . 73.22 110.786 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 19.4 mtm180 -110.68 -175.57 2.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 74.11 110.8 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.832 HD13 ' CG ' ' A' ' 25' ' ' HIS . 18.7 tt -150.21 157.27 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 73.53 111.11 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.639 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 3.2 ttp -134.83 141.57 46.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 65.33 110.838 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 19.3 t -111.91 138.44 40.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.454 . . . . 64.25 111.163 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.1 mtt -105.65 -56.84 2.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 73.33 110.887 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.459 ' HD3' ' N ' ' A' ' 68' ' ' SER . 0.0 OUTLIER -118.74 144.48 46.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 71.24 110.835 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.459 ' N ' ' HD3' ' A' ' 67' ' ' ARG . 14.2 t -69.25 -179.6 1.65 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.479 . . . . 74.3 110.898 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.473 ' CD2' ' HG ' ' A' ' 54' ' ' SER . 20.5 m-70 -109.27 145.76 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 74.32 110.852 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.7 t -93.4 6.19 49.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 71.02 110.848 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.438 ' CG ' HD13 ' A' ' 50' ' ' LEU . 26.2 p80 -137.32 165.63 25.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 52.53 110.911 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -100.42 150.31 36.84 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.61 0.719 . . . . 75.24 110.913 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.497 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.5 Cg_endo -69.74 158.86 55.53 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.664 2.243 . . . . 63.31 112.292 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -139.81 90.54 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.472 . . . . 63.14 110.871 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.8 mt -55.82 -14.23 2.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.232 -0.44 . . . . 70.43 110.909 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.4 -49.06 58.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 72.21 111.07 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.99 -32.94 34.57 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.746 -0.74 . . . . 65.2 112.487 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.427 HD11 ' HE ' ' A' ' 82' ' ' ARG . 7.3 tp -67.79 -39.93 83.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 62.22 110.925 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -63.4 -24.8 68.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.134 -0.484 . . . . 73.4 110.91 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.22 70.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 74.24 111.097 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.485 HD12 HD11 ' A' ' 29' ' ' LEU . 50.3 mt -63.85 -51.67 63.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 73.23 110.909 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.907 ' HG3' HD21 ' A' ' 14' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 74.41 110.953 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.597 HD22 ' HB ' ' A' ' 63' ' ' ILE . 13.5 tp . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.765 0.316 . . . . 72.44 110.924 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -112.59 140.74 47.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 75.54 110.971 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.568 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 70.3 m-85 -139.84 172.91 12.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 61.54 110.887 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.672 HD12 ' CG2' ' A' ' 24' ' ' VAL . 6.3 mt -151.78 162.5 40.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.132 -0.486 . . . . 75.43 110.841 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 73.43 110.842 179.915 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.436 ' NE ' ' O ' ' A' ' 14' ' ' LEU . 5.9 tpt180 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.85 0.357 . . . . 71.42 110.88 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -105.43 160.53 15.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 72.53 110.925 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.566 HD13 ' CE1' ' A' ' 13' ' ' PHE . 20.3 tp -119.66 125.27 48.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 71.51 110.936 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.672 ' CG2' HD12 ' A' ' 14' ' ' LEU . 20.9 t -106.15 123.0 60.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 65.23 111.162 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.788 ' CG ' HD13 ' A' ' 63' ' ' ILE . 64.9 t60 -153.02 138.77 17.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.138 -0.483 . . . . 75.33 110.877 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 54.82 24.68 5.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 74.34 110.878 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m 75.24 26.63 1.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.487 . . . . 44.51 110.903 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -124.94 -176.07 3.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 74.32 110.899 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.645 HD13 ' NE ' ' A' ' 45' ' ' ARG . 56.0 mt -128.98 147.56 50.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 65.44 110.888 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.602 ' CD1' ' C ' ' A' ' 29' ' ' LEU . 1.0 OUTLIER -144.77 173.75 11.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 65.21 110.915 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -135.59 141.91 45.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.126 -0.488 . . . . 72.31 110.887 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.2 tttm -64.35 115.51 5.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 73.24 110.882 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -92.91 -57.18 2.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 71.34 110.926 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -150.6 179.04 8.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.487 . . . . 53.11 110.951 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -136.88 117.73 14.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 54.02 111.177 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.57 -175.57 3.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 62.04 111.04 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -48.97 94.36 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.72 -0.752 . . . . 71.24 112.494 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 62.51 34.59 15.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.934 0.397 . . . . 73.23 110.887 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -145.33 158.03 43.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 74.13 110.885 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.1 t -138.25 114.17 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 62.41 111.114 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -78.69 146.07 34.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 74.32 110.914 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.545 ' CD2' HD22 ' A' ' 23' ' ' LEU . 69.5 m95 -135.88 151.85 50.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.079 -0.509 . . . . 62.31 110.905 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -134.93 129.82 34.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 65.23 110.895 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.6 t -42.81 116.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 74.45 110.859 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.645 ' NE ' HD13 ' A' ' 29' ' ' LEU . 18.3 ptt180 -55.14 -20.55 10.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 60.32 110.874 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.54 36.44 0.54 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 65.0 110.854 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -88.43 -18.88 27.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.143 -0.48 . . . . 74.52 110.913 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.12 -31.05 12.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 64.01 111.144 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.0 ttm-85 -95.05 -57.36 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 71.23 110.811 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.475 ' O ' ' N ' ' A' ' 52' ' ' CYS . 22.6 mt -95.61 22.65 6.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 63.2 110.915 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.94 29.66 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.687 -0.768 . . . . 73.23 112.466 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.475 ' N ' ' O ' ' A' ' 50' ' ' LEU . 4.7 t -75.76 127.66 33.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.844 0.354 . . . . 74.21 110.852 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.33 -10.92 17.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 74.32 110.844 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 m -39.32 128.26 1.8 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.229 -0.441 . . . . 51.32 110.86 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.401 ' C ' ' HG3' ' A' ' 66' ' ' MET . 16.0 mtt85 -123.82 166.03 16.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 74.42 110.842 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.476 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -149.72 156.51 41.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 75.05 111.075 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 91.0 mt -125.42 122.49 62.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 71.11 111.121 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.675 HG22 HG13 ' A' ' 63' ' ' ILE . 34.3 p -101.1 142.43 32.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 74.32 111.128 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.95 87.17 2.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 73.13 110.95 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.45 -85.23 1.56 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.721 -0.752 . . . . 71.13 112.486 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.89 -1.24 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.771 0.32 . . . . 63.31 110.855 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.444 ' CZ ' ' HB3' ' A' ' 62' ' ' ARG . 1.4 mtp-105 -102.71 174.39 5.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 62.32 110.888 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.788 HD13 ' CG ' ' A' ' 25' ' ' HIS . 4.9 tt -145.06 154.14 14.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 72.01 111.114 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.476 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 9.4 ttp -138.16 142.66 40.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.149 -0.478 . . . . 75.42 110.882 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.1 t -95.14 145.03 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 74.33 111.067 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.401 ' HG3' ' C ' ' A' ' 55' ' ' ARG . 31.0 mtp -104.77 -61.04 1.51 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.088 -0.505 . . . . 74.31 110.783 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -123.02 162.65 21.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 70.23 110.888 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.34 153.91 29.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 43.4 110.86 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -92.37 137.86 32.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.099 -0.5 . . . . 75.04 110.848 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 51.9 t -89.48 10.1 24.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 72.25 110.865 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.44 ' CB ' HD13 ' A' ' 50' ' ' LEU . 31.8 p80 -136.93 142.81 42.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 73.5 110.801 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -79.8 155.59 75.49 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.587 0.708 . . . . 74.23 110.914 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.66 155.86 65.14 Favored 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.743 2.295 . . . . 70.11 112.365 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -133.14 80.37 1.88 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 70.41 110.884 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.514 HD23 ' N ' ' A' ' 75' ' ' LEU . 3.4 mt -45.78 -23.85 0.31 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.234 -0.439 . . . . 74.12 110.848 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.57 -43.18 73.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 54.31 111.088 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -77.99 -36.8 30.94 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.753 -0.737 . . . . 70.03 112.465 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tp -69.64 -37.39 76.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.741 0.305 . . . . 75.21 110.94 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -68.98 -29.44 67.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 74.14 110.904 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.63 93.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.1 -0.5 . . . . 64.12 111.102 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 61.4 mt -67.98 -46.96 69.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.23 -0.441 . . . . 65.15 110.966 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.8 mtp-105 . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.791 179.97 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.615 HD21 HD11 ' A' ' 23' ' ' LEU . 28.8 tp . . . . . 0 N--CA 1.458 -0.036 0 CA-C-O 120.77 0.319 . . . . 73.23 110.951 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.464 ' OE1' HG11 ' A' ' 24' ' ' VAL . 41.3 tt0 -98.15 147.47 24.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.463 . . . . 73.2 110.858 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.537 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 52.3 m-85 -136.68 172.86 12.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 63.05 110.874 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.507 HD12 ' CG2' ' A' ' 24' ' ' VAL . 5.0 mt -147.51 158.29 43.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 72.45 110.923 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 73.12 110.876 179.939 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.6 ttt85 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.851 0.358 . . . . 74.44 110.915 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.556 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -100.99 170.73 8.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 73.0 110.855 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.615 HD11 HD21 ' A' ' 11' ' ' LEU . 4.3 tp -139.1 138.17 36.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 72.31 110.93 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.507 ' CG2' HD12 ' A' ' 14' ' ' LEU . 18.1 t -104.26 126.55 58.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 71.42 111.093 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.771 ' CG ' HD13 ' A' ' 63' ' ' ILE . 5.2 t60 -159.73 132.28 6.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.128 -0.487 . . . . 72.23 110.844 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 53.17 37.79 25.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 64.41 110.9 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 72.1 m 63.05 26.7 15.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 65.01 110.857 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -126.68 164.11 22.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 73.53 110.807 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.552 HD12 ' CZ ' ' A' ' 45' ' ' ARG . 62.6 mt -115.3 137.64 51.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 72.22 110.867 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.536 ' CE1' ' HB3' ' A' ' 25' ' ' HIS . 1.6 m-85 -127.16 168.02 15.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 71.41 110.995 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.556 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 12.4 mtp-105 -128.72 118.38 22.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 72.04 110.893 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.446 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 32.8 tttm -41.57 116.6 0.79 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.444 . . . . 70.24 110.836 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -91.5 -54.34 3.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.219 -0.446 . . . . 73.11 110.906 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.91 -178.19 6.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 74.24 110.894 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.89 135.19 20.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 60.12 111.13 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -104.81 36.49 2.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 53.32 111.076 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.25 -63.27 4.45 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.722 -0.751 . . . . 74.24 112.43 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -101.75 -26.87 13.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.964 0.411 . . . . 63.2 110.866 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.9 mtmp? -105.4 159.91 15.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.483 . . . . 75.31 110.86 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.4 t -137.57 116.75 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 74.44 111.179 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.557 ' CE2' HD11 ' A' ' 57' ' ' ILE . 3.4 m-85 -80.75 145.9 31.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 63.04 110.954 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.542 ' CD1' HG23 ' A' ' 58' ' ' THR . 77.1 m95 -137.29 148.7 46.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 71.03 110.874 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 12.2 ptt? -131.62 126.88 35.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 63.53 110.843 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -42.54 120.78 1.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 74.31 110.85 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.552 ' CZ ' HD12 ' A' ' 29' ' ' LEU . 19.8 ptt180 -53.02 -17.84 1.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 63.25 110.884 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.564 ' HB3' HD12 ' A' ' 50' ' ' LEU . 1.1 m-20 -87.88 17.45 4.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.903 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.41 ' C ' ' CD ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -78.49 -15.5 58.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.227 -0.442 . . . . 61.22 110.888 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.403 ' HB2' ' OE1' ' A' ' 47' ' ' GLN . . . -96.76 -32.85 11.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 63.44 111.05 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -98.38 -62.51 1.23 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 74.01 110.843 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.564 HD12 ' HB3' ' A' ' 46' ' ' ASP . 31.6 mt -83.12 15.45 2.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 52.11 110.922 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.61 33.54 1.55 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.789 -0.72 . . . . 71.51 112.429 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.405 ' N ' ' HA ' ' A' ' 47' ' ' GLN . 38.1 t -77.75 108.91 11.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.8 0.333 . . . . 75.14 110.92 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -84.35 12.56 6.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 74.31 110.856 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.1 t -60.22 113.41 2.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 75.45 110.874 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.6 mtm180 -119.34 137.94 53.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 75.54 110.867 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.64 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -126.6 160.43 30.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 74.42 111.132 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.557 HD11 ' CE2' ' A' ' 41' ' ' TYR . 31.6 mt -128.23 128.36 68.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 74.1 111.158 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.542 HG23 ' CD1' ' A' ' 42' ' ' TRP . 19.3 p -101.95 147.39 26.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 74.12 111.205 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -142.83 106.89 4.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 72.43 110.875 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 69.93 -92.86 0.39 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.744 -0.741 . . . . 75.01 112.51 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -128.82 6.91 5.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.772 0.32 . . . . 75.1 110.887 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 39.4 mtp85 -108.03 -175.93 2.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.287 -0.415 . . . . 74.12 110.867 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.771 HD13 ' CG ' ' A' ' 25' ' ' HIS . 9.8 tt -150.35 153.41 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 74.31 111.104 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.64 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 68.2 mtm -135.92 146.88 47.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 71.4 110.832 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.2 t -116.51 132.23 66.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 70.44 111.13 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mmm -92.02 -58.55 2.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 55.1 110.891 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -118.44 160.19 22.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 74.04 110.861 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.2 m -78.62 -179.71 6.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 61.1 110.76 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -108.26 139.83 42.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.105 -0.498 . . . . 60.42 110.814 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.1 t -94.52 15.91 16.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 54.14 110.922 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.458 ' CB ' HD13 ' A' ' 50' ' ' LEU . 24.3 p80 -145.25 150.89 37.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.144 -0.48 . . . . 71.53 110.826 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -81.07 152.43 71.32 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.579 0.704 . . . . 62.21 110.964 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 149.61 67.36 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.708 2.272 . . . . 73.11 112.372 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.33 81.42 1.89 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.271 -0.422 . . . . 51.21 110.837 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 34.7 mt -53.95 -23.48 13.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 73.52 110.971 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.0 -45.71 66.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 55.02 111.147 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.01 -31.38 43.41 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.728 -0.749 . . . . 53.21 112.519 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tp -70.68 -38.3 73.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.723 0.297 . . . . 71.55 110.911 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -68.55 -23.46 64.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.254 -0.43 . . . . 74.44 110.849 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.55 -44.57 86.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 41.4 111.077 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.2 mt -69.92 -50.35 42.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 75.21 110.885 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.433 ' HG3' HD11 ' A' ' 14' ' ' LEU . 50.3 mtp180 . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 71.24 110.879 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.725 HD21 HD11 ' A' ' 23' ' ' LEU . 24.5 tp . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.703 0.287 . . . . 70.31 110.968 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 -101.24 152.87 20.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.212 -0.449 . . . . 61.11 110.942 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.696 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 61.6 m-85 -137.93 169.93 16.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.832 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.623 HD12 ' CG2' ' A' ' 24' ' ' VAL . 4.1 mt -145.08 165.21 28.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 53.34 110.956 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 71.33 110.899 179.872 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.5 tpt85 . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.831 0.348 . . . . 63.44 110.813 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.471 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -103.55 165.54 10.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 64.25 110.878 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.725 HD11 HD21 ' A' ' 11' ' ' LEU . 8.4 tp -130.4 135.13 47.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 53.2 110.946 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 1.022 HG11 ' NH2' ' A' ' 82' ' ' ARG . 68.0 t -101.85 116.92 46.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 73.33 111.072 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.643 ' CG ' HD13 ' A' ' 63' ' ' ILE . 10.7 t60 -152.83 127.03 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 70.21 110.874 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 59.89 43.43 14.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 72.2 110.867 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.438 ' OG ' ' CD2' ' A' ' 75' ' ' LEU . 1.4 t 56.89 20.11 5.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.122 -0.49 . . . . 74.02 110.88 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.411 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 20.1 m-85 -116.52 -177.38 3.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 74.21 110.928 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.45 HD12 ' HE ' ' A' ' 45' ' ' ARG . 65.8 mt -134.14 134.08 41.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 74.31 110.897 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.511 ' N ' ' CD1' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -125.93 172.03 10.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 75.31 110.956 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.471 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 59.4 mtp180 -131.7 129.08 40.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 73.54 110.924 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.43 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 51.6 tttm -54.86 122.07 9.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 62.52 110.934 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -94.06 -54.81 3.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 64.35 110.903 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.05 164.57 37.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.5 . . . . 75.12 110.846 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.48 131.98 54.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.439 . . . . 72.45 111.096 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -101.97 37.13 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.288 -0.414 . . . . 74.32 111.12 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.98 -73.39 2.31 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.682 -0.771 . . . . 62.01 112.453 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -102.95 -11.28 18.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 72.43 110.9 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 27.5 mtmm -115.38 156.57 25.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 73.41 110.897 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.0 t -133.79 114.42 19.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 74.44 111.144 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -77.74 149.06 34.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 72.2 110.967 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.481 ' CD1' HG23 ' A' ' 58' ' ' THR . 77.2 m95 -139.84 165.21 27.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 75.52 110.952 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 19.4 ptt? -151.45 133.58 15.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 72.12 110.845 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.7 t -46.22 118.17 1.82 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 75.15 110.88 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.45 ' HE ' HD12 ' A' ' 29' ' ' LEU . 41.6 ptt85 -52.06 -23.89 5.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 73.31 110.878 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -81.98 12.34 4.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 71.43 110.788 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.415 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 5.3 tm0? -71.46 -17.45 62.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.184 -0.462 . . . . 75.15 110.931 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.15 -36.76 11.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 74.24 111.109 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.3 mtt85 -93.54 -62.75 1.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 71.34 110.886 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.417 ' O ' ' C ' ' A' ' 51' ' ' GLY . 39.7 mt -84.25 18.32 2.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.469 . . . . 64.21 110.849 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.48 38.63 0.29 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.771 -0.728 . . . . 71.21 112.497 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 32.7 t -78.2 102.32 7.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.819 0.342 . . . . 72.31 110.865 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -81.91 45.61 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 63.33 110.913 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.8 t -100.04 111.7 23.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 71.04 110.921 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -107.17 161.07 15.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 73.22 110.921 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.641 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -149.86 162.6 39.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.257 -0.428 . . . . 55.24 111.116 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 74.6 mt -134.26 125.34 47.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 74.22 111.151 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.481 HG23 ' CD1' ' A' ' 42' ' ' TRP . 32.2 p -101.58 150.84 22.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.451 . . . . 73.21 111.15 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -147.71 112.97 5.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 71.13 110.954 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 65.25 -92.75 0.15 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.796 -0.716 . . . . 71.44 112.558 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.94 2.49 5.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.811 0.338 . . . . 75.2 110.883 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.1 mtt85 -102.33 -175.31 2.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 73.42 110.796 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.643 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -151.0 156.35 6.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 72.52 111.118 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.641 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 49.3 mtm -136.49 149.05 47.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.451 . . . . 74.32 110.894 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.5 t -121.55 133.89 66.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 63.21 111.121 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.4 mtp -93.56 -63.43 1.2 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.14 -0.482 . . . . 61.33 110.834 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -112.82 167.95 10.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 71.45 110.854 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.5 m -84.99 -177.55 6.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 74.12 110.883 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -110.04 137.87 47.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 71.1 110.903 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.6 t -91.79 13.96 16.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 71.24 110.872 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 24.0 p80 -143.8 159.33 42.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 73.03 110.825 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -90.83 153.87 45.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.609 0.719 . . . . 73.43 110.891 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.411 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.3 Cg_endo -69.83 139.46 40.04 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.716 2.277 . . . . 73.42 112.289 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 77' ' ' GLY . 13.1 t0 -101.27 79.35 1.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 74.05 110.874 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.438 ' CD2' ' OG ' ' A' ' 27' ' ' SER . 7.9 mt -46.88 -24.64 0.62 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 73.11 110.935 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.66 -26.29 19.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 73.34 111.124 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 74' ' ' ASP . . . -84.07 -46.62 5.84 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.738 -0.744 . . . . 74.05 112.496 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.4 tp -67.71 -35.63 79.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 73.33 110.914 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -72.26 -31.44 65.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.161 -0.472 . . . . 62.34 110.952 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.72 -44.88 95.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 55.25 111.123 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.6 mt -60.18 -41.38 92.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 70.3 110.978 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 1.022 ' NH2' HG11 ' A' ' 24' ' ' VAL . 10.7 mtt180 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.145 -0.48 . . . . 70.45 110.901 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.975 HD21 HD11 ' A' ' 23' ' ' LEU . 20.4 tp . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.701 0.286 . . . . 71.32 110.944 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -105.31 148.28 27.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 71.54 110.88 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -139.81 172.86 12.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.128 -0.487 . . . . 74.24 110.863 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.765 HD21 ' HG2' ' A' ' 82' ' ' ARG . 6.3 mt -150.65 118.51 6.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.138 -0.483 . . . . 64.14 110.926 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.5 mtp180 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.04 110.832 179.972 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.46 ' HD3' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.895 0.379 . . . . 74.41 110.825 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.46 ' N ' ' HD3' ' A' ' 21' ' ' ARG . 2.6 m-85 -126.32 157.48 38.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 73.54 110.9 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.975 HD11 HD21 ' A' ' 11' ' ' LEU . 15.7 tp -120.58 116.47 25.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.152 -0.476 . . . . 71.05 110.979 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.585 ' CG2' HD12 ' A' ' 14' ' ' LEU . 58.8 t -90.88 114.52 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 62.32 111.074 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.8 ' CG ' HD13 ' A' ' 63' ' ' ILE . 6.9 t60 -151.6 127.13 10.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.138 -0.483 . . . . 63.23 110.868 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 62.97 38.51 11.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 72.12 110.897 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 m 60.03 29.19 18.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.091 -0.504 . . . . 74.44 110.855 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -130.48 178.15 6.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 51.4 110.882 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.421 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 32.1 mt -130.43 132.76 45.88 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.093 -0.503 . . . . 65.53 110.883 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.523 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -127.28 167.53 16.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 52.42 110.907 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.2 mtp180 -126.96 138.92 53.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.119 -0.492 . . . . 74.42 110.856 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 25.2 tttm -59.51 116.76 4.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 75.1 110.884 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -91.63 -52.93 4.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 73.42 110.86 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.64 ' NZ ' ' CD2' ' A' ' 41' ' ' TYR . 1.8 pttm -160.53 177.84 10.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 74.22 110.862 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.33 120.02 14.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 52.43 111.026 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.27 38.16 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.481 . . . . 54.02 111.082 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 102.73 -89.13 0.7 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.728 -0.749 . . . . 51.22 112.468 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -96.72 -4.43 40.74 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.825 0.345 . . . . 72.14 110.823 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.419 ' HB2' ' HZ2' ' A' ' 39' ' ' LYS . 5.9 mtmp? -113.7 158.61 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 73.53 110.855 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 t -136.26 119.24 22.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 72.13 111.107 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.64 ' CD2' ' NZ ' ' A' ' 34' ' ' LYS . 3.3 m-85 -81.31 151.19 28.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 61.41 110.941 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.676 ' CD1' HG23 ' A' ' 58' ' ' THR . 75.4 m95 -141.49 146.32 36.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 73.53 110.912 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.7 ptt? -129.26 144.56 51.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 72.34 110.871 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -55.13 108.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.432 . . . . 70.23 110.887 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.421 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.9 ptt-85 -39.98 -30.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 74.33 110.9 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -77.88 51.91 0.99 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 71.11 110.849 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -75.49 -51.8 12.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.252 -0.431 . . . . 62.13 110.909 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -98.0 -13.9 20.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 64.22 111.064 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 mmt-85 -81.82 -61.15 2.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 74.11 110.906 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.3 mt -108.01 26.75 9.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 74.22 110.928 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 38.4 42.45 1.31 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.789 -0.72 . . . . 75.35 112.469 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.7 t -96.32 130.01 43.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.79 0.328 . . . . 74.34 110.88 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -111.83 17.78 19.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.474 . . . . 71.42 110.841 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.9 t -69.51 127.88 34.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 72.03 110.832 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -121.62 173.15 7.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 72.01 110.899 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.744 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -155.52 163.76 39.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.466 . . . . 60.32 111.108 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 97.7 mt -128.37 121.71 56.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 64.44 111.089 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.676 HG23 ' CD1' ' A' ' 42' ' ' TRP . 20.1 p -101.08 151.27 22.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 73.45 111.151 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.18 113.14 2.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.465 . . . . 72.13 110.866 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 73.48 -101.11 1.13 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.793 -0.718 . . . . 73.51 112.486 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -127.06 7.12 6.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.736 0.303 . . . . 75.23 110.861 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.06 -175.42 2.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 70.14 110.868 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.8 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.89 162.72 3.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 73.21 111.102 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.744 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 1.5 ttp -143.5 148.84 36.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 75.12 110.889 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.6 t -113.64 144.38 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.426 . . . . 71.2 111.093 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 14.3 mtp -104.67 -61.61 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 72.23 110.895 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 52.9 mtt-85 -111.44 170.73 7.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 73.41 110.892 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 80.6 p -88.88 -177.91 5.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 75.31 110.858 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -116.01 138.96 50.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.067 -0.515 . . . . 74.3 110.866 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 4.3 t -90.98 8.35 35.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 71.32 110.837 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 26.5 p80 -135.59 157.76 46.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 63.32 110.792 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -91.62 151.79 42.76 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.568 0.699 . . . . 62.44 110.878 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 150.24 67.73 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.682 2.255 . . . . 75.21 112.347 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.56 81.37 1.97 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.231 -0.44 . . . . 72.23 110.913 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.443 HD23 ' N ' ' A' ' 75' ' ' LEU . 6.0 mt -48.25 -28.28 2.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 70.51 110.96 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.64 77.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 71.52 111.143 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.98 -29.23 59.25 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.741 -0.742 . . . . 72.52 112.516 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.1 tp -76.72 -41.09 46.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.761 0.315 . . . . 54.24 110.914 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -75.52 -23.43 56.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 71.21 110.908 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.92 -18.4 47.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 63.04 111.067 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.0 mt -80.56 -41.48 24.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 73.5 110.884 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.765 ' HG2' HD21 ' A' ' 14' ' ' LEU . 14.8 mtm180 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 75.21 110.854 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 1.032 HD21 HD11 ' A' ' 23' ' ' LEU . 31.5 tp . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.746 0.308 . . . . 74.44 110.925 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -98.65 159.9 14.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 71.23 110.853 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -139.31 171.9 13.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.475 . . . . 63.13 110.861 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.607 HD21 ' HG2' ' A' ' 82' ' ' ARG . 11.4 mt -148.16 128.14 13.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.126 -0.488 . . . . 74.21 110.967 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.1 mtp-105 . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 74.32 110.875 179.962 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.0 ttm180 . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.86 0.362 . . . . 72.42 110.899 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.491 ' N ' ' O ' ' A' ' 14' ' ' LEU . 3.0 m-85 -143.76 158.52 43.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 75.34 110.842 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 1.032 HD11 HD21 ' A' ' 11' ' ' LEU . 12.8 tp -126.46 115.85 20.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 75.11 110.903 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.582 HG22 HD12 ' A' ' 14' ' ' LEU . 59.4 t -89.56 122.79 41.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 73.33 111.111 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.902 ' CG ' HD13 ' A' ' 63' ' ' ILE . 33.7 t60 -161.3 134.04 6.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 64.24 110.907 179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.498 ' HG2' ' CE1' ' A' ' 25' ' ' HIS . 40.4 mm-40 60.19 29.7 19.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 72.24 110.905 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.7 m 65.74 27.71 11.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 74.42 110.845 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.535 ' CE2' ' CD2' ' A' ' 69' ' ' HIS . 16.6 m-85 -126.07 -174.26 3.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 72.14 110.963 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.445 HD21 HD12 ' A' ' 14' ' ' LEU . 40.7 mt -135.31 130.9 35.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.22 110.898 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.468 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 2.0 m-85 -127.42 159.42 34.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.137 -0.483 . . . . 72.54 110.922 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.474 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 3.7 mtt-85 -116.33 148.8 40.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.103 -0.499 . . . . 74.14 110.873 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 41.3 tttp -71.13 109.12 4.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 71.42 110.916 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.475 ' CD ' ' C ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -83.78 -59.6 2.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.432 . . . . 62.41 110.898 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -153.85 -176.37 5.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 75.33 110.884 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -137.9 119.75 15.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 54.33 111.109 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.434 ' O ' ' N ' ' A' ' 38' ' ' GLU . . . -102.41 -174.73 2.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.31 -0.404 . . . . 53.44 111.157 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -45.35 93.16 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.722 -0.752 . . . . 72.41 112.506 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 36' ' ' ALA . 22.0 mt-10 58.68 40.53 23.22 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.905 0.383 . . . . 64.0 110.926 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.5 mtmm -150.93 157.93 43.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 63.3 110.845 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.5 t -135.13 117.45 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.172 -0.467 . . . . 71.44 111.175 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -82.3 135.02 35.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 75.11 110.935 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.589 ' CD1' HG23 ' A' ' 58' ' ' THR . 75.2 m95 -123.97 161.89 24.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.125 -0.489 . . . . 74.42 110.962 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -146.12 127.18 14.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.28 -0.418 . . . . 74.01 110.897 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.5 t -41.67 112.43 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.298 -0.41 . . . . 14.15 110.88 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.474 ' HB2' ' CZ ' ' A' ' 31' ' ' ARG . 19.8 ptt180 -42.28 -46.85 4.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 44.52 110.894 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.498 ' HB2' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -80.07 56.7 2.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.182 -0.463 . . . . 75.2 110.82 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.417 ' OE1' ' CA ' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -88.99 -38.75 14.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 75.22 110.88 -179.906 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.417 ' CA ' ' OE1' ' A' ' 47' ' ' GLN . . . -89.12 -68.97 0.74 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 70.44 111.099 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -41.64 -61.87 1.0 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.32 110.801 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.498 HD12 ' HB2' ' A' ' 46' ' ' ASP . 23.4 mt -77.75 -18.93 55.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 65.53 110.898 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.96 37.85 28.28 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.75 -0.738 . . . . 64.24 112.452 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.4 t -90.68 143.87 26.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.839 0.352 . . . . 63.01 110.887 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.8 mmt85 -125.54 31.49 5.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 63.42 110.906 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.7 t -88.7 137.58 32.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 64.43 110.897 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -125.63 141.87 51.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 75.33 110.938 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.46 152.11 51.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 62.24 111.095 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.584 HG22 ' N ' ' A' ' 58' ' ' THR . 91.8 mt -117.64 162.24 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 70.3 111.141 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.589 HG23 ' CD1' ' A' ' 42' ' ' TRP . 43.2 p -141.0 136.89 32.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 74.2 111.211 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.56 109.43 4.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 75.55 110.874 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 79.16 -101.03 1.81 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.763 -0.732 . . . . 54.43 112.45 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -128.96 9.17 5.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.735 0.302 . . . . 74.25 110.841 -179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -112.71 -179.82 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 75.51 110.826 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.902 HD13 ' CG ' ' A' ' 25' ' ' HIS . 14.4 tt -146.64 159.83 10.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 75.41 111.142 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.409 ' N ' HG12 ' A' ' 63' ' ' ILE . 36.5 mtm -139.73 152.28 46.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 73.52 110.843 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 50.3 t -119.62 139.58 46.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.219 -0.446 . . . . 72.54 111.135 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mmm -97.97 -51.79 3.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 74.32 110.868 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -128.13 172.74 10.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 63.02 110.902 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 51.0 p -87.68 -179.04 6.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 72.21 110.861 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.535 ' CD2' ' CE2' ' A' ' 28' ' ' PHE . 86.4 m-70 -111.05 136.56 49.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 65.12 110.902 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.5 p -79.45 -4.17 49.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 71.0 110.862 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.449 ' NE2' ' OD1' ' A' ' 46' ' ' ASP . 12.0 p80 -121.97 178.98 4.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 71.42 110.839 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -109.36 150.21 40.8 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.654 0.74 . . . . 45.3 110.873 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.76 155.29 66.32 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.668 2.246 . . . . 34.31 112.356 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -136.8 100.04 4.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.258 -0.428 . . . . 64.32 110.881 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mt -63.94 -21.42 66.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 73.34 110.875 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -76.51 -61.98 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 75.4 111.138 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.17 -33.49 64.92 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.763 -0.732 . . . . 74.41 112.512 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 tp -72.79 -48.1 40.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.775 0.321 . . . . 73.13 110.948 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -59.73 -29.1 67.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.451 . . . . 74.42 110.832 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.33 96.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 25.34 111.132 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 mt -75.96 -26.37 56.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.283 -0.417 . . . . 73.25 110.972 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.607 ' HG2' HD21 ' A' ' 14' ' ' LEU . 72.7 mtp85 . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 71.11 110.905 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.682 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 33.8 tp . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.824 0.345 . . . . 73.12 110.91 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -105.33 151.9 23.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.183 -0.462 . . . . 72.53 110.891 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.682 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 66.4 m-85 -139.79 172.89 12.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 72.21 110.891 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.704 HD12 ' CG2' ' A' ' 24' ' ' VAL . 5.2 mt -147.27 156.5 42.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 65.3 110.881 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.0 tpp85 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 74.41 110.806 179.971 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.791 0.329 . . . . 73.53 110.864 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.421 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -99.61 167.78 10.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 73.34 110.893 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.493 HD11 HD21 ' A' ' 11' ' ' LEU . 7.0 tp -134.38 132.66 39.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 70.55 110.905 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.704 ' CG2' HD12 ' A' ' 14' ' ' LEU . 55.8 t -98.44 113.35 32.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 74.34 111.128 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.701 ' CG ' HD13 ' A' ' 63' ' ' ILE . 6.2 t60 -149.43 122.67 8.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 74.32 110.838 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 63.46 47.74 3.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.156 -0.474 . . . . 75.14 110.938 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.96 25.54 3.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 50.02 110.871 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -123.28 -179.17 4.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.082 -0.508 . . . . 72.45 110.903 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.507 HD21 ' CD1' ' A' ' 14' ' ' LEU . 22.6 mt -131.34 139.09 49.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.186 -0.461 . . . . 73.5 110.949 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.508 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -133.16 159.64 39.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.465 . . . . 71.32 110.924 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.421 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -123.47 124.57 43.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 62.34 110.912 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -46.37 112.94 0.55 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 63.31 110.838 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -90.35 -53.38 4.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 72.03 110.885 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.3 ptmm? -161.25 -176.61 5.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -143.67 133.3 23.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.27 -0.423 . . . . 43.12 111.075 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -109.82 69.14 0.69 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 64.11 111.079 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.77 -101.08 2.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.72 -0.752 . . . . 43.24 112.533 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -101.54 1.18 37.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.87 0.367 . . . . 70.54 110.924 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.409 ' CE ' HG21 ' A' ' 57' ' ' ILE . 48.2 mtpt -112.58 143.69 43.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.117 -0.492 . . . . 62.34 110.876 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.89 119.6 60.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 62.53 111.069 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.426 ' N ' ' CD1' ' A' ' 41' ' ' TYR . 6.5 m-30 -78.52 144.59 35.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.201 -0.454 . . . . 72.43 110.971 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.487 ' CD1' HG23 ' A' ' 58' ' ' THR . 79.7 m95 -136.08 123.09 21.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 64.11 110.939 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.8 ptt? -106.84 139.75 40.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 53.15 110.894 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.0 t -54.03 115.54 2.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 72.33 110.907 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 21.7 ptt-85 -41.59 -34.54 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.834 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -82.82 45.49 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 72.1 110.852 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.726 HE21 ' HB2' ' A' ' 48' ' ' ALA . 4.1 pp0? -87.28 -27.97 22.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 73.43 110.937 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.726 ' HB2' HE21 ' A' ' 47' ' ' GLN . . . -97.85 -25.45 15.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 54.01 111.094 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 23.7 ttm-85 -90.8 -59.97 2.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 74.31 110.87 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.442 ' O ' ' N ' ' A' ' 52' ' ' CYS . 37.8 mt -96.53 22.7 7.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.2 -0.454 . . . . 72.51 110.888 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 37.76 29.63 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.822 -0.704 . . . . 75.34 112.536 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.442 ' N ' ' O ' ' A' ' 50' ' ' LEU . 4.7 t -80.92 99.32 8.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.827 0.346 . . . . 72.01 110.871 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 30.3 mmm-85 -80.6 7.38 10.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 74.25 110.869 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.9 t -54.82 110.92 0.72 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 54.42 110.83 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -112.36 166.97 10.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 64.41 110.916 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.692 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -148.36 166.67 27.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 53.51 111.11 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.409 HG21 ' CE ' ' A' ' 39' ' ' LYS . 86.8 mt -132.47 123.58 50.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 65.24 111.063 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.487 HG23 ' CD1' ' A' ' 42' ' ' TRP . 49.1 p -102.91 153.5 20.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.48 . . . . 64.53 111.161 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -153.12 109.82 3.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 51.23 110.857 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 71.46 -96.73 0.65 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.703 -0.761 . . . . 63.13 112.505 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.07 9.17 6.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.328 . . . . 71.12 110.857 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.434 ' HB3' ' NH1' ' A' ' 62' ' ' ARG . 14.8 mtp-105 -110.99 -176.92 3.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 64.14 110.858 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.701 HD13 ' CG ' ' A' ' 25' ' ' HIS . 19.4 tt -148.03 160.58 7.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.454 . . . . 63.44 111.072 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.692 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 8.1 ttp -142.53 148.44 37.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 74.42 110.847 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 93.4 t -118.57 141.97 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 72.12 111.091 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 9.4 mmm -105.59 -61.93 1.43 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 60.21 110.886 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.418 ' HD3' ' N ' ' A' ' 68' ' ' SER . 1.9 tmt_? -114.03 148.61 36.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 64.33 110.875 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.418 ' N ' ' HD3' ' A' ' 67' ' ' ARG . 13.7 p -68.73 -175.5 0.7 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 62.03 110.906 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.4 ' CE1' ' HH ' ' A' ' 30' ' ' TYR . 91.8 m-70 -112.07 142.86 43.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 74.2 110.812 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.3 t -92.39 9.16 35.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 73.1 110.807 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 28.5 p80 -138.97 161.3 37.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 71.02 110.835 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -94.23 155.43 39.93 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.609 0.718 . . . . 64.41 110.945 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.82 155.55 65.43 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.709 2.273 . . . . 64.14 112.32 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -134.46 80.25 1.84 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.83 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.596 HD23 ' N ' ' A' ' 75' ' ' LEU . 0.7 OUTLIER -46.57 -24.16 0.49 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 75.02 110.947 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.53 -50.97 32.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.143 -0.481 . . . . 74.31 111.131 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.32 -37.88 80.62 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.679 -0.772 . . . . 63.53 112.473 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.434 HD21 HH11 ' A' ' 82' ' ' ARG . 6.0 tp -69.7 -41.8 74.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.779 0.323 . . . . 63.11 110.918 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -60.96 -23.3 65.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.137 -0.483 . . . . 70.34 110.845 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.75 -60.56 2.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 53.21 111.065 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.2 mt -52.86 -45.92 67.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.948 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.504 ' HG2' HD21 ' A' ' 14' ' ' LEU . 36.4 mtp180 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.46 . . . . 71.24 110.907 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.853 HD21 HD11 ' A' ' 23' ' ' LEU . 15.4 tp . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.792 0.33 . . . . 75.31 110.923 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -105.41 141.52 36.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 72.22 110.87 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.647 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 19.7 m-85 -139.36 170.18 16.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 75.42 110.921 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 mt -143.72 146.59 33.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.155 -0.475 . . . . 72.03 110.888 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 62.0 mtp85 . . . . . 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 74.4 110.909 179.961 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.812 0.339 . . . . 75.22 110.909 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -129.69 158.81 38.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 71.1 110.873 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.853 HD11 HD21 ' A' ' 11' ' ' LEU . 11.2 tp -122.22 115.34 22.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.194 -0.457 . . . . 65.32 110.908 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.5 t -89.95 116.33 31.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 72.21 111.158 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.806 ' CG ' HD13 ' A' ' 63' ' ' ILE . 14.3 t60 -153.97 129.25 9.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 71.53 110.889 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 62.66 37.76 12.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 74.41 110.904 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m 60.19 26.1 15.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 51.14 110.901 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.468 ' CE1' ' CE1' ' A' ' 71' ' ' HIS . 13.4 m-85 -126.82 -176.82 3.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 74.25 110.859 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.43 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 14.7 mt -134.33 134.25 41.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 63.41 110.915 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.508 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.1 m-85 -129.16 169.16 15.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.249 -0.432 . . . . 74.54 110.99 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -129.32 138.01 51.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.869 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.478 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 38.3 tttt -61.88 113.33 2.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 72.22 110.911 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -88.62 -47.56 8.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 74.43 110.909 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -157.28 169.27 25.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 74.14 110.906 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.72 123.14 23.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 73.0 111.152 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.3 34.73 1.39 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.449 . . . . 71.35 111.12 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.64 -88.7 0.94 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.708 -0.758 . . . . 64.24 112.537 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -92.29 -0.22 57.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.891 0.377 . . . . 63.33 110.883 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -121.6 157.78 30.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 72.12 110.837 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.456 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 2.5 t -138.46 112.9 8.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.236 -0.438 . . . . 70.53 111.123 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -77.11 139.3 39.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.114 -0.493 . . . . 71.11 110.978 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.585 ' CG ' HD22 ' A' ' 23' ' ' LEU . 81.6 m95 -128.48 165.98 19.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.148 -0.478 . . . . 63.35 110.889 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -151.84 140.68 20.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 73.53 110.919 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.0 t -51.06 106.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 71.03 110.872 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.43 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.3 ptt-85 -40.17 -33.63 0.25 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 63.34 110.844 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.97 52.35 0.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 65.52 110.874 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -73.12 -50.83 20.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.232 -0.44 . . . . 71.52 110.886 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.19 -10.01 26.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 74.21 111.028 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.3 ttt180 -84.03 -60.34 2.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 74.52 110.847 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 52' ' ' CYS . 94.3 mt -106.78 25.62 11.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.187 -0.461 . . . . 74.5 110.956 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.73 23.25 0.18 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.754 -0.736 . . . . 35.52 112.528 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 50' ' ' LEU . 6.1 t -77.46 141.44 39.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.791 0.329 . . . . 72.02 110.861 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.13 22.32 9.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 71.45 110.861 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.521 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 47.8 t -66.42 135.45 54.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 53.03 110.843 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 -128.72 160.5 32.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.086 -0.506 . . . . 71.23 110.839 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.445 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -154.86 150.3 27.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 25.41 111.067 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.463 HD12 ' CE ' ' A' ' 66' ' ' MET . 51.5 mt -120.38 131.61 72.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.446 . . . . 74.34 111.152 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.423 HG23 ' CD1' ' A' ' 42' ' ' TRP . 36.6 p -108.88 144.5 36.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 74.04 111.134 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -134.06 87.09 2.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.241 -0.436 . . . . 73.35 110.947 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.45 -87.07 1.55 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.753 -0.737 . . . . 73.41 112.413 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -126.25 -10.76 6.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.755 0.312 . . . . 70.34 110.871 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 51.8 mtm180 -92.4 -179.96 5.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.452 . . . . 74.42 110.951 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.806 HD13 ' CG ' ' A' ' 25' ' ' HIS . 19.8 tt -150.92 158.91 4.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 73.21 111.151 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.445 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 2.4 ttp -144.14 142.01 30.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 62.23 110.882 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 23.0 t -102.53 140.75 20.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 71.04 111.132 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.463 ' CE ' HD12 ' A' ' 57' ' ' ILE . 26.3 mmm -113.35 -64.12 1.35 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.506 . . . . 73.44 110.917 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -101.58 137.29 40.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 71.1 110.912 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 85.2 p -69.29 177.83 2.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 61.42 110.86 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.521 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 47.4 m-70 -111.52 145.74 38.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.102 -0.499 . . . . 72.32 110.886 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 8.6 t -97.44 13.78 28.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 70.12 110.955 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . 0.468 ' CE1' ' CE1' ' A' ' 28' ' ' PHE . 28.3 p80 -140.67 178.87 7.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.497 . . . . 62.42 110.833 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -111.46 152.2 43.78 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.589 0.709 . . . . 72.2 110.878 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.412 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.77 157.31 60.8 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.654 2.236 . . . . 63.22 112.328 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -135.93 83.64 2.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 75.35 110.841 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 12.6 mt -47.42 -29.54 2.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.227 -0.442 . . . . 71.23 110.901 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.96 -51.15 50.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.49 . . . . 52.12 111.162 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.65 -41.77 98.94 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.747 -0.739 . . . . 41.25 112.457 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tp -68.56 -51.51 41.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.793 0.33 . . . . 42.11 110.924 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -50.61 -22.59 2.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.44 110.858 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.414 ' O ' ' C ' ' A' ' 81' ' ' LEU . . . -69.55 -67.81 0.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 74.42 111.06 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.414 ' C ' ' O ' ' A' ' 80' ' ' ALA . 6.6 mt -37.4 -52.31 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 65.02 110.904 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.453 . . . . 74.24 110.848 179.942 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.668 HD21 HD11 ' A' ' 23' ' ' LEU . 27.9 tp . . . . . 0 CA--C 1.526 0.044 0 CA-C-O 120.741 0.305 . . . . 64.15 110.909 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -88.06 134.4 33.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 74.12 110.915 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.654 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 64.2 m-85 -133.56 172.87 12.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.123 -0.49 . . . . 74.35 110.886 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.621 HD12 ' CG2' ' A' ' 24' ' ' VAL . 10.9 mt -146.82 150.26 34.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.158 -0.474 . . . . 54.51 110.891 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.466 . . . . 73.23 110.838 -179.996 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 tpp85 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.898 0.38 . . . . 73.13 110.83 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -117.01 158.19 24.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 74.44 110.943 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.668 HD11 HD21 ' A' ' 11' ' ' LEU . 13.7 tp -124.88 115.99 21.51 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 75.13 110.939 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.621 ' CG2' HD12 ' A' ' 14' ' ' LEU . 41.4 t -90.62 113.53 26.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 71.12 111.107 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.627 ' CG ' HD13 ' A' ' 63' ' ' ILE . 15.3 t60 -148.43 124.51 10.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 71.43 110.868 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 62.73 44.37 6.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 74.1 110.87 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.6 m 55.79 25.27 8.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 62.53 110.793 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -125.99 172.93 9.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 70.44 110.86 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.474 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 33.5 mt -125.94 134.45 51.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 62.31 110.92 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.6 m-85 -127.75 167.3 16.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 74.4 110.912 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -132.6 133.37 43.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 74.23 110.903 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.533 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 73.5 tttt -55.81 114.92 2.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.246 -0.434 . . . . 72.31 110.935 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -88.88 -57.22 2.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 73.33 110.842 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.529 ' HD2' ' CG ' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -151.45 -177.69 6.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 64.35 110.85 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -132.92 138.92 47.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.461 . . . . 74.45 111.124 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -110.72 35.98 3.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 61.31 111.107 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.1 -78.59 0.52 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.843 -0.694 . . . . 72.12 112.466 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -105.02 -20.4 13.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.91 0.386 . . . . 74.15 110.875 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -98.98 163.94 12.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.197 -0.456 . . . . 64.33 110.902 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.0 t -134.32 120.68 34.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 61.42 111.104 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.529 ' CG ' ' HD2' ' A' ' 34' ' ' LYS . 2.9 m-85 -79.34 142.26 36.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 75.5 110.878 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.533 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 80.6 m95 -134.93 150.69 50.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 72.1 110.905 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -133.06 138.03 46.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 53.24 110.876 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.403 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.9 t -51.3 104.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 61.33 110.895 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.474 ' CZ ' HD13 ' A' ' 29' ' ' LEU . 15.9 ptt180 -40.47 -28.4 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 72.31 110.829 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 44' ' ' CYS . 2.9 m-20 -87.86 48.49 1.65 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.248 -0.433 . . . . 71.44 110.882 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -83.3 -40.45 19.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.198 -0.456 . . . . 75.32 110.892 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.37 -9.55 38.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 65.03 111.071 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -97.33 -55.26 2.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 73.51 110.838 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.436 ' O ' ' C ' ' A' ' 51' ' ' GLY . 28.4 mt -106.69 26.9 9.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 75.2 110.938 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . 0.436 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.62 56.13 0.78 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.677 -0.773 . . . . 61.4 112.529 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.6 t -126.47 118.34 24.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.835 0.35 . . . . 54.12 110.893 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.9 mmt-85 -93.44 2.74 56.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.205 -0.452 . . . . 74.42 110.874 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.468 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 37.8 t -40.82 105.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.871 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -102.93 -179.74 4.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 74.1 110.878 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.812 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -162.62 167.04 23.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 74.32 111.15 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 57.8 mt -131.52 123.89 53.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.287 -0.415 . . . . 70.21 111.11 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.84 HG22 HG13 ' A' ' 63' ' ' ILE . 31.3 p -108.92 141.19 41.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 75.31 111.133 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -147.24 111.54 5.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 70.53 110.886 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.73 -102.42 2.35 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.823 -0.704 . . . . 63.24 112.507 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -129.0 10.35 5.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.786 0.327 . . . . 74.0 110.87 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -113.27 -174.99 2.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 74.22 110.893 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.84 HG13 HG22 ' A' ' 58' ' ' THR . 18.5 tt -150.02 152.8 11.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 72.35 111.117 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.812 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 21.4 mtm -134.52 148.77 50.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 62.33 110.878 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.3 t -117.23 138.21 48.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 63.41 111.093 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 11.2 mtp -107.96 -54.69 2.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.485 . . . . 65.45 110.923 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.74 160.52 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 63.23 110.898 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 p -95.75 167.04 11.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 72.33 110.844 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.468 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 38.0 m-70 -104.07 129.97 51.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 74.45 110.82 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.0 t -89.06 13.11 13.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.163 -0.471 . . . . 55.21 110.868 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 19.1 p80 -133.34 172.79 12.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 74.11 110.837 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -104.65 151.41 39.27 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.711 . . . . 75.34 110.926 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 151.6 69.06 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.666 2.244 . . . . 73.24 112.303 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -112.7 81.76 1.54 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.189 -0.46 . . . . 54.11 110.834 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.9 mt -51.33 -17.69 0.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 52.14 110.857 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.86 -55.1 3.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 31.52 111.12 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.99 -37.52 91.59 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.717 -0.754 . . . . 52.3 112.526 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 12.6 tp -68.87 -51.01 44.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.779 0.323 . . . . 65.21 110.946 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -53.34 -30.93 41.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 75.2 110.87 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.05 -28.54 66.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 41.32 111.09 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mt -79.2 -39.02 34.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 72.3 110.885 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.506 ' HG2' HD21 ' A' ' 14' ' ' LEU . 4.0 mtp-105 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 72.51 110.847 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.553 HD22 ' HB ' ' A' ' 63' ' ' ILE . 11.8 tp . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.823 0.344 . . . . 74.31 110.872 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 13' ' ' PHE . 8.1 tp10 -103.56 146.57 28.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 74.23 110.958 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.409 ' N ' ' HG3' ' A' ' 12' ' ' GLU . 25.7 m-85 -139.44 172.93 12.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 72.22 110.84 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.9 mt -142.06 157.68 44.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 73.04 110.905 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.426 ' HD2' ' N ' ' A' ' 15' ' ' ARG . 2.5 mpt_? . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 72.42 110.849 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.817 0.341 . . . . 71.12 110.892 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -112.55 159.75 18.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.29 -0.414 . . . . 74.13 110.927 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.406 HD11 HD21 ' A' ' 11' ' ' LEU . 6.7 tp -131.96 130.72 41.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 73.3 110.953 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.7 t -97.1 111.43 27.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 44.22 111.137 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.663 ' CD2' HD13 ' A' ' 63' ' ' ILE . 2.3 t60 -148.05 129.55 14.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.429 . . . . 75.3 110.855 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 59.88 38.59 21.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 73.14 110.892 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 m 61.22 18.29 9.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.484 . . . . 73.31 110.863 -179.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -116.71 179.53 3.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 65.03 110.85 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 27.9 mt -130.37 135.4 48.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 74.14 110.886 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' TYR . . . . . 0.499 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.2 m-85 -128.37 163.01 25.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.278 -0.419 . . . . 74.25 110.911 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.4 mtt180 -117.48 126.55 52.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 70.31 110.808 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.509 ' HB2' ' CZ3' ' A' ' 42' ' ' TRP . 54.2 tttt -54.55 110.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 71.45 110.882 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.429 ' CD ' ' C ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -81.38 -58.63 2.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 61.14 110.934 179.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.83 -177.57 5.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 75.15 110.884 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -141.03 109.31 5.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 64.13 111.13 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.61 90.31 7.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 71.33 111.083 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 58.35 -92.89 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.737 -0.744 . . . . 74.43 112.505 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.446 ' N ' ' CD ' ' A' ' 38' ' ' GLU . 9.1 mp0 -106.99 9.97 30.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 74.11 110.871 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.5 mtmt -116.48 155.76 28.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 63.34 110.96 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 15.4 t -134.51 122.6 40.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.313 -0.403 . . . . 55.33 111.139 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -87.18 141.8 28.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.465 . . . . 63.41 110.851 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' TRP . . . . . 0.509 ' CZ3' ' HB2' ' A' ' 32' ' ' LYS . 67.5 m95 -135.29 163.38 30.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.082 -0.508 . . . . 75.3 110.94 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 12.3 ptt? -150.17 140.36 22.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.3 -0.409 . . . . 73.55 110.919 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -52.85 107.58 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 73.12 110.889 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.1 ptt-85 -40.23 -31.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 75.22 110.947 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -81.96 43.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 75.41 110.888 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -85.33 -34.93 21.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.209 -0.45 . . . . 72.25 110.866 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -96.24 -14.97 22.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 63.42 111.035 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -97.04 -58.72 1.95 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.271 -0.422 . . . . 71.0 110.901 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.0 mt -99.49 21.9 11.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 75.21 110.926 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.56 37.82 1.97 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.764 -0.732 . . . . 73.31 112.43 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 30.9 t -93.87 110.42 22.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.82 0.343 . . . . 41.14 110.838 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.414 ' O ' ' CD ' ' A' ' 55' ' ' ARG . 0.9 OUTLIER -91.94 19.38 6.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 74.01 110.893 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.5 t -63.09 108.49 1.25 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 73.51 110.92 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.469 ' HB3' ' HE2' ' A' ' 66' ' ' MET . 1.1 mpt_? -107.06 156.4 18.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 71.34 110.888 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -138.8 167.68 21.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.31 111.117 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.778 ' HB ' ' HE3' ' A' ' 64' ' ' MET . 55.2 mt -141.57 123.42 13.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.192 -0.458 . . . . 65.23 111.104 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.824 HG22 HG13 ' A' ' 63' ' ' ILE . 18.4 p -109.33 149.94 28.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.113 -0.494 . . . . 71.44 111.149 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.47 89.06 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 72.41 110.867 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 86.61 -87.56 1.56 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.733 -0.746 . . . . 71.2 112.477 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -126.5 -8.19 6.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.817 0.341 . . . . 52.13 110.898 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -91.4 -177.4 4.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 65.14 110.855 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.824 HG13 HG22 ' A' ' 58' ' ' THR . 5.9 tt -150.49 153.8 9.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 73.22 111.122 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' MET . . . . . 0.778 ' HE3' ' HB ' ' A' ' 57' ' ' ILE . 3.6 tmm? -138.87 151.52 47.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 71.2 110.85 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.7 t -111.58 134.07 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 75.23 111.173 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.469 ' HE2' ' HB3' ' A' ' 55' ' ' ARG . 13.0 mtm -103.26 -36.03 8.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 60.21 110.871 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -140.05 160.18 40.51 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.245 -0.434 . . . . 75.15 110.899 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.2 m -86.11 -179.52 6.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.186 -0.461 . . . . 74.01 110.826 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' HIS . . . . . 0.437 ' CE1' ' HH ' ' A' ' 30' ' ' TYR . 70.6 m-70 -113.15 137.44 51.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 71.42 110.844 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.8 t -94.24 14.27 20.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 61.41 110.883 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -140.69 173.6 11.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 71.43 110.822 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -106.34 152.29 40.5 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.589 0.709 . . . . 60.43 110.832 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 167.02 25.71 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.719 2.279 . . . . 74.45 112.358 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -144.35 82.93 1.71 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.28 -0.418 . . . . 72.43 110.866 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.1 mt -47.03 -25.47 0.83 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 72.31 110.895 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.25 -42.52 83.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.05 111.102 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.61 -38.31 21.0 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.777 -0.725 . . . . 72.12 112.468 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tp -67.64 -41.45 83.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.75 0.309 . . . . 43.23 110.915 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -63.81 -25.56 68.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.192 -0.458 . . . . 75.2 110.906 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.39 -51.6 59.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 41.51 111.138 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.18 -30.78 71.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 74.3 110.869 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mtp-105 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.446 . . . . 62.24 110.92 179.939 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.39 0 N-CA-C 112.515 -0.234 . . . . 70.53 112.515 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.1 m -128.95 110.05 11.76 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.847 0.356 . . . . 75.22 110.882 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 m -134.14 131.17 38.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.129 -0.487 . . . . 74.23 110.855 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.38 164.87 29.36 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.724 -0.751 . . . . 72.35 112.533 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.1 t -124.49 112.59 17.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.901 0.382 . . . . 32.24 110.888 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 81.0 p -153.7 145.19 23.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 55.43 110.842 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -56.6 -61.42 7.5 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.756 -0.735 . . . . 71.14 112.435 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.466 HD12 ' HG2' ' A' ' 62' ' ' ARG . 14.7 tp -87.75 98.15 11.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.753 0.311 . . . . 72.34 110.857 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -86.76 145.96 40.12 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.635 0.731 . . . . 73.13 110.826 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.434 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 53.0 Cg_endo -69.85 -172.33 0.57 Allowed 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.721 2.281 . . . . 70.42 112.33 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.487 ' H ' ' CE1' ' A' ' 61' ' ' HIS . 16.4 tp -154.83 146.45 23.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 52.42 110.888 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -106.19 150.24 26.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 61.13 110.875 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -137.81 172.47 12.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 71.13 110.807 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.43 HD21 ' CG ' ' A' ' 82' ' ' ARG . 8.5 mt -142.11 157.53 44.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.065 -0.516 . . . . 63.43 110.883 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 88.9 mtt180 -127.97 124.52 37.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 64.21 110.875 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.472 HG23 ' O ' ' A' ' 20' ' ' GLY . 0.1 OUTLIER -120.07 165.52 14.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 74.03 111.126 -179.885 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.45 ' O ' ' C ' ' A' ' 18' ' ' LEU . 6.3 m -54.13 -174.02 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.25 -0.432 . . . . 74.44 110.851 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.45 ' C ' ' O ' ' A' ' 17' ' ' SER . 0.0 OUTLIER -34.56 101.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.105 -0.498 . . . . 72.12 110.885 179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.03 -22.34 0.11 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.722 -0.751 . . . . 52.51 112.482 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.472 ' O ' HG23 ' A' ' 16' ' ' THR . . . 115.72 -166.68 12.28 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.764 -0.731 . . . . 74.22 112.454 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.11 150.53 27.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.836 0.351 . . . . 63.24 110.904 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -99.49 167.88 10.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 73.13 110.927 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.485 HD11 HD21 ' A' ' 11' ' ' LEU . 10.0 tp -129.43 125.98 37.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 73.04 110.951 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.578 HG11 ' NH2' ' A' ' 82' ' ' ARG . 77.6 t -95.38 116.57 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.237 -0.438 . . . . 64.23 111.119 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.801 ' CG ' HD13 ' A' ' 63' ' ' ILE . 9.0 t60 -154.77 126.08 7.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 72.44 110.902 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 63.89 38.51 8.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.151 -0.477 . . . . 73.42 110.847 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.1 m 58.55 24.61 12.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 71.24 110.858 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -121.52 -177.3 3.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.115 -0.493 . . . . 74.02 110.887 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.574 HD12 ' HE ' ' A' ' 45' ' ' ARG . 69.8 mt -132.76 132.98 42.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.093 -0.503 . . . . 45.41 110.935 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.499 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -127.63 170.07 13.08 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.175 -0.466 . . . . 73.45 110.888 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.452 ' NE ' ' HB2' ' A' ' 45' ' ' ARG . 20.3 mtt180 -131.18 137.09 48.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.108 -0.496 . . . . 55.43 110.83 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.45 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 37.6 tttt -64.42 110.52 2.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 62.45 110.9 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -82.66 -59.25 2.58 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.207 -0.451 . . . . 63.42 110.888 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.484 ' HE2' ' CD2' ' A' ' 41' ' ' TYR . 10.1 pttm -142.81 177.87 8.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.852 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -142.79 120.8 12.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.245 -0.434 . . . . 62.14 111.098 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.85 32.68 0.8 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 70.23 111.1 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 83.07 -60.31 4.91 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.753 -0.737 . . . . 73.04 112.508 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -105.79 -13.04 15.66 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.864 0.364 . . . . 74.22 110.859 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.444 ' HG2' ' CG ' ' A' ' 59' ' ' GLN . 36.2 mtmt -121.24 148.36 44.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.158 -0.474 . . . . 74.33 110.877 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.414 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 3.5 t -125.76 111.12 25.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 72.4 111.152 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.484 ' CD2' ' HE2' ' A' ' 34' ' ' LYS . 3.6 m-85 -79.72 141.77 36.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 61.25 110.928 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.475 ' CD1' HG23 ' A' ' 58' ' ' THR . 63.6 m95 -130.29 166.28 20.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.033 -0.53 . . . . 75.41 110.938 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.0 ptt? -146.75 135.49 22.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.27 -0.423 . . . . 64.14 110.879 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.9 t -50.16 109.6 0.31 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 63.43 110.869 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.574 ' HE ' HD12 ' A' ' 29' ' ' LEU . 39.1 ptt85 -44.48 -23.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.45 . . . . 74.43 110.923 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.485 ' HB3' HD12 ' A' ' 50' ' ' LEU . 0.5 OUTLIER -85.47 30.86 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.131 -0.486 . . . . 61.33 110.856 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -82.01 -26.11 34.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 75.02 110.913 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.04 -23.56 16.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.214 -0.448 . . . . 71.31 111.17 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.0 tpp85 -96.7 -60.56 1.58 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.477 . . . . 64.21 110.86 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.535 HD13 ' CG ' ' A' ' 71' ' ' HIS . 34.8 mt -94.34 22.79 5.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.464 . . . . 71.42 110.889 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 38.08 41.88 1.08 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.742 -0.742 . . . . 63.21 112.486 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.2 t -90.26 120.76 31.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.907 0.384 . . . . 70.1 110.814 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -99.3 13.33 33.49 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 63.33 110.862 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.7 t -65.03 117.74 8.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 64.24 110.874 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 57.4 mtm180 -114.87 159.4 20.71 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.153 -0.476 . . . . 75.22 110.917 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.697 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -144.74 164.45 30.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 71.32 111.097 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 64' ' ' MET . 69.1 mt -127.25 129.23 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 75.32 111.124 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.475 HG23 ' CD1' ' A' ' 42' ' ' TRP . 42.2 p -110.36 136.84 48.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.456 . . . . 63.1 111.156 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.444 ' CG ' ' HG2' ' A' ' 39' ' ' LYS . 4.7 mt-30 -144.48 116.23 8.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.45 . . . . 74.12 110.945 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 70.19 -99.2 0.69 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.71 -0.757 . . . . 64.2 112.535 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.487 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -128.26 4.84 5.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.763 0.316 . . . . 75.01 110.803 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.466 ' HG2' HD12 ' A' ' 8' ' ' LEU . 42.5 mtm180 -107.01 -175.22 2.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.248 -0.433 . . . . 73.21 110.817 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.801 HD13 ' CG ' ' A' ' 25' ' ' HIS . 21.3 tt -150.81 162.75 3.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 70.2 111.074 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.697 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 3.9 mpp? -141.6 147.66 37.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.108 -0.496 . . . . 62.22 110.864 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 43.7 t -116.76 130.13 72.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 71.04 111.121 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 19.4 mtp -89.42 -64.08 1.19 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.211 -0.449 . . . . 72.32 110.852 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.9 ttm180 -112.34 175.93 5.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.268 -0.424 . . . . 74.13 110.901 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 25.4 p -90.99 -176.18 4.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 75.32 110.909 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -114.17 137.71 51.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 74.04 110.889 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.3 t -93.27 13.88 19.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.234 -0.439 . . . . 71.42 110.839 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.535 ' CG ' HD13 ' A' ' 50' ' ' LEU . 26.7 p80 -141.48 169.29 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 74.31 110.866 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.441 ' CD ' ' N ' ' A' ' 72' ' ' GLN . 1.8 mp0 -102.57 151.79 38.29 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.576 0.703 . . . . 55.54 110.92 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.88 149.6 66.32 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.639 2.226 . . . . 63.33 112.347 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -124.76 81.14 1.92 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.221 -0.445 . . . . 75.54 110.816 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.403 ' N ' HD23 ' A' ' 75' ' ' LEU . 6.5 mt -48.75 -22.9 0.88 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.153 -0.476 . . . . 62.35 110.919 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -75.24 -41.33 57.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.4 111.103 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -80.68 -31.38 36.59 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.724 -0.75 . . . . 71.42 112.486 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.6 tp -68.72 -38.31 80.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.707 0.289 . . . . 72.31 110.891 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -70.3 -34.72 73.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.187 -0.46 . . . . 75.33 110.896 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.93 -20.09 66.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 73.42 111.062 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.518 HD13 ' CD1' ' A' ' 29' ' ' LEU . 3.0 mt -90.15 -21.92 21.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 73.54 110.888 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.578 ' NH2' HG11 ' A' ' 24' ' ' VAL . 28.9 mtt180 -82.96 -28.66 29.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 74.34 110.877 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.732 ' O ' HD13 ' A' ' 87' ' ' LEU . 0.9 OUTLIER -60.7 -43.28 97.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.265 -0.425 . . . . 74.15 110.952 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.423 ' N ' ' CG ' ' A' ' 83' ' ' GLN . 1.7 ptm180 -71.64 -5.61 34.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.118 -0.492 . . . . 73.55 110.823 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -100.79 -40.35 7.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 72.23 110.872 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.411 ' C ' HD12 ' A' ' 87' ' ' LEU . 23.1 mtp180 -82.8 14.78 3.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.173 -0.467 . . . . 70.32 110.852 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.732 HD13 ' O ' ' A' ' 83' ' ' GLN . 6.8 mp . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 63.32 110.894 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.448 -0.261 . . . . 45.1 112.448 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.2 p -49.12 144.85 4.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.856 0.36 . . . . 71.23 110.872 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.8 t -133.97 82.71 1.99 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 60.11 110.848 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -161.35 42.04 0.4 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.803 -0.713 . . . . 74.4 112.526 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.8 p -89.75 122.05 32.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.857 0.361 . . . . 63.14 110.882 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.8 m -121.93 138.67 54.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 45.22 110.858 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 126.83 -4.07 7.46 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.726 -0.749 . . . . 70.52 112.5 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.453 ' HB2' ' CG ' ' A' ' 62' ' ' ARG . 1.3 pt? -175.11 141.4 0.57 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.768 0.318 . . . . 71.25 110.894 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.449 ' N ' ' HD3' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -75.1 144.14 78.53 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.681 0.753 . . . . 62.33 110.855 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.513 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 53.9 Cg_endo -69.73 -165.2 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.69 2.26 . . . . 73.05 112.367 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.74 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 14.5 tp -151.88 145.23 24.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.207 -0.452 . . . . 74.24 110.931 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.449 ' C ' ' CD1' ' A' ' 13' ' ' PHE . 34.0 tt0 -113.52 145.73 40.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 72.51 110.911 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.74 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 0.8 OUTLIER -140.0 167.9 21.06 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 75.4 110.898 -179.925 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.859 HD21 ' HG2' ' A' ' 82' ' ' ARG . 8.9 mt -137.57 117.53 13.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.195 -0.457 . . . . 63.42 111.012 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -73.11 135.71 44.79 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.213 -0.449 . . . . 72.21 110.903 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 p -115.99 150.82 36.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 72.2 111.152 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 p -80.58 123.76 28.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 63.41 110.877 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.9 mt 41.25 28.17 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 73.45 110.97 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -121.49 -25.4 2.19 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.771 -0.728 . . . . 63.33 112.488 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 120.71 -143.2 16.24 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.679 -0.772 . . . . 51.31 112.493 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -129.04 144.79 51.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.811 0.339 . . . . 63.33 110.833 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -110.95 164.27 12.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 63.11 110.909 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.635 HD11 HD21 ' A' ' 11' ' ' LEU . 5.4 tp -129.16 113.68 15.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 74.54 110.962 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.4 t -88.01 112.08 23.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 74.03 111.11 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.808 ' CG ' HD13 ' A' ' 63' ' ' ILE . 9.2 t60 -149.27 125.49 10.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.151 -0.477 . . . . 72.44 110.821 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 63.21 42.96 6.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.24 -0.436 . . . . 75.11 110.904 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.7 m 56.05 19.94 4.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 45.15 110.902 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -116.83 -175.42 2.77 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.016 -0.538 . . . . 63.12 110.915 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 44.5 mt -136.61 133.6 36.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.161 -0.472 . . . . 71.34 110.922 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.515 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -129.23 163.06 26.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 73.43 110.914 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.8 mtp180 -124.77 139.88 53.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 71.2 110.928 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.8 tttt -60.91 116.18 4.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.233 -0.44 . . . . 72.12 110.898 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -91.97 -57.57 2.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.172 -0.467 . . . . 75.21 110.904 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 49.7 pttt -151.32 168.48 24.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.135 -0.484 . . . . 63.14 110.924 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -132.7 119.19 20.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 63.1 111.09 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -82.54 38.01 0.54 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.19 -0.459 . . . . 74.34 111.067 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.21 -50.59 4.0 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.755 -0.736 . . . . 60.1 112.5 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -114.44 -27.81 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.908 0.385 . . . . 54.52 110.878 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.767 ' HE2' HD13 ' A' ' 57' ' ' ILE . 52.0 mtpt -104.61 154.81 19.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.176 -0.465 . . . . 73.2 110.883 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 t -127.87 111.97 26.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.275 -0.421 . . . . 74.23 111.102 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.521 ' CZ ' HD11 ' A' ' 57' ' ' ILE . 3.4 m-85 -79.45 145.27 33.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 62.13 110.893 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.619 ' CD1' HG23 ' A' ' 58' ' ' THR . 66.5 m95 -135.3 163.14 30.66 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.117 -0.492 . . . . 73.14 110.875 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.9 ptt? -145.79 132.06 19.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 71.02 110.909 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.406 ' C ' ' N ' ' A' ' 46' ' ' ASP . 1.8 t -46.1 108.46 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 72.44 110.813 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -43.49 -23.65 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 70.35 110.858 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.446 ' CB ' HD12 ' A' ' 50' ' ' LEU . 3.3 m-20 -81.39 42.06 0.65 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 64.51 110.822 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -85.8 -36.09 20.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 71.23 110.934 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.89 -14.57 20.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 63.31 111.128 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.0 tpp180 -98.91 -53.71 3.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 60.15 110.914 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.447 ' O ' ' C ' ' A' ' 51' ' ' GLY . 33.9 mt -108.01 27.34 9.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.201 -0.454 . . . . 72.44 110.903 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.447 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.63 47.08 0.61 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.761 -0.733 . . . . 70.41 112.484 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.3 t -97.59 142.71 29.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.759 0.314 . . . . 40.04 110.895 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.43 ' N ' ' HD2' ' A' ' 53' ' ' ARG . 0.4 OUTLIER -118.37 -0.87 11.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.172 -0.467 . . . . 74.14 110.926 179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.556 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . 1.1 t -52.43 116.13 2.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.205 -0.452 . . . . 64.03 110.862 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.6 mtm105 -111.14 171.16 7.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 72.04 110.819 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.635 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -160.68 151.32 18.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.173 -0.467 . . . . 74.42 111.092 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.767 HD13 ' HE2' ' A' ' 39' ' ' LYS . 23.0 mt -115.49 130.16 70.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 74.22 111.099 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.619 HG23 ' CD1' ' A' ' 42' ' ' TRP . 28.3 p -111.32 141.47 44.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 50.21 111.156 179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.415 ' NE2' ' HG2' ' A' ' 39' ' ' LYS . 10.7 mt-30 -146.72 109.3 4.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.224 -0.444 . . . . 75.25 110.9 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 75.29 -95.95 0.98 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.718 -0.753 . . . . 72.42 112.448 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.513 ' CD2' ' HA ' ' A' ' 10' ' ' PRO . 1.4 t60 -129.03 1.18 5.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.804 0.335 . . . . 73.42 110.818 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.453 ' CG ' ' HB2' ' A' ' 8' ' ' LEU . 19.7 mmm-85 -102.79 -176.41 3.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.275 -0.42 . . . . 74.13 110.894 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.808 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.4 161.97 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.199 -0.455 . . . . 63.44 111.158 -180.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.635 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 16.8 ttm -138.62 141.28 39.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 61.22 110.933 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.2 t -106.41 133.25 51.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 53.03 111.129 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 23.5 mmt -93.87 -65.1 1.01 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.165 -0.471 . . . . 74.12 110.956 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.9 mtt180 -119.5 -178.27 3.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 63.53 110.903 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 77.3 p -91.82 -175.36 4.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 73.02 110.895 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.556 ' CE1' ' HB3' ' A' ' 54' ' ' SER . 75.8 m-70 -117.84 144.09 45.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.168 -0.469 . . . . 63.05 110.896 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 90.0 m -97.07 11.2 37.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 72.03 110.873 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 28.6 p80 -139.08 166.28 24.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 72.31 110.873 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -97.7 152.29 38.06 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.569 0.699 . . . . 74.05 110.953 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.71 160.31 50.2 Favored 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 122.755 2.303 . . . . 64.23 112.264 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -140.24 93.48 2.64 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.115 -0.493 . . . . 75.52 110.841 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.754 HD23 ' N ' ' A' ' 75' ' ' LEU . 0.5 OUTLIER -60.99 -22.18 64.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 74.24 110.93 -179.93 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.2 -55.38 9.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 63.13 111.124 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.22 -29.1 74.29 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.687 -0.768 . . . . 73.23 112.536 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 10.9 tp -77.33 -48.59 16.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.788 0.327 . . . . 60.02 110.896 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -64.19 -25.0 67.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.194 -0.457 . . . . 63.55 110.849 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.44 -25.73 63.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 74.41 111.121 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mt -79.12 -49.63 12.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.166 -0.47 . . . . 62.21 110.915 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.859 ' HG2' HD21 ' A' ' 14' ' ' LEU . 19.8 mtm180 -55.07 -53.62 53.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.143 -0.481 . . . . 54.54 110.907 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -40.42 -40.3 1.17 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.161 -0.472 . . . . 72.32 110.913 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -62.81 -40.8 98.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 74.04 110.881 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.436 ' N ' ' O ' ' A' ' 82' ' ' ARG . 25.6 mm-40 -78.83 -56.88 4.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.185 -0.461 . . . . 70.54 110.869 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.422 ' NE ' ' O ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -133.78 163.74 28.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.104 -0.498 . . . . 72.21 110.816 -179.885 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.8 mt . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.48 . . . . 74.03 110.964 -179.965 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 N-CA-C 112.494 -0.242 . . . . 52.12 112.494 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.2 p -90.65 36.24 0.89 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.933 0.397 . . . . 53.23 110.88 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.8 p -112.75 132.7 55.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 72.43 110.916 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -165.63 -105.03 0.18 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.712 -0.756 . . . . 44.01 112.474 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 8.4 t 69.13 26.16 5.6 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.835 0.35 . . . . 53.25 110.819 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 8.4 t -85.4 80.0 9.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.189 -0.46 . . . . 71.12 110.919 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 92.03 -107.61 3.53 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.706 -0.759 . . . . 71.11 112.465 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.715 HD12 ' CG ' ' A' ' 62' ' ' ARG . 1.4 pt? -62.79 139.48 58.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.805 0.336 . . . . 75.15 110.916 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -70.03 144.01 92.31 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.6 0.715 . . . . 72.34 110.881 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.516 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 53.5 Cg_endo -69.8 -163.83 0.12 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.649 2.233 . . . . 70.13 112.383 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.743 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 15.8 tp -159.82 143.31 14.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.243 -0.435 . . . . 71.54 110.875 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -106.42 151.04 25.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.148 -0.478 . . . . 43.13 110.85 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.743 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 48.9 m-85 -139.98 170.52 15.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 74.42 110.866 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.5 mt -143.89 162.25 36.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.18 -0.464 . . . . 71.24 110.936 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.7 mtt85 -127.23 136.51 52.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 74.31 110.896 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.2 p -100.97 142.87 31.83 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.221 -0.445 . . . . 72.32 111.18 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -39.07 -49.65 1.78 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 63.34 110.93 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.1 mt -79.78 172.88 13.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.117 -0.492 . . . . 75.3 110.944 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -63.97 78.77 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.648 -0.787 . . . . 71.44 112.5 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -165.27 136.87 4.39 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.772 -0.727 . . . . 70.32 112.501 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -111.33 151.18 28.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.803 0.335 . . . . 73.52 110.899 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -116.04 165.29 13.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.223 -0.444 . . . . 75.24 110.904 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.591 HD22 ' CG ' ' A' ' 42' ' ' TRP . 10.6 tp -131.71 117.59 18.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.146 -0.479 . . . . 73.24 110.86 -179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.685 HG11 ' NH2' ' A' ' 82' ' ' ARG . 97.5 t -93.55 111.7 25.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.202 -0.453 . . . . 73.33 111.101 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.817 ' CG ' HD13 ' A' ' 63' ' ' ILE . 57.5 t60 -147.98 132.61 17.81 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.207 -0.451 . . . . 73.24 110.832 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.422 ' HG3' ' NE2' ' A' ' 25' ' ' HIS . 23.6 mt-10 59.6 35.58 22.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 73.21 110.892 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m 63.43 29.32 15.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 75.04 110.909 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 22.1 m-85 -130.72 -178.17 4.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 70.34 110.91 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.408 HD13 ' HE ' ' A' ' 45' ' ' ARG . 16.2 mt -133.38 133.15 42.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 72.5 110.913 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.495 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.2 m-85 -125.71 161.51 27.13 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 60.23 110.919 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.473 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 3.3 mtt-85 -115.63 126.35 54.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 72.4 110.822 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.505 ' HB2' ' CH2' ' A' ' 42' ' ' TRP . 15.6 ttpt -57.45 110.07 0.8 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.451 . . . . 73.41 110.86 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -82.38 -58.14 3.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 74.43 110.891 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.1 pttp -149.88 -176.66 5.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 45.33 110.88 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.58 117.17 7.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 65.52 111.173 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.34 80.23 4.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.216 -0.447 . . . . 51.12 111.098 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.68 -78.14 0.37 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.717 -0.754 . . . . 64.41 112.503 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -116.19 -13.8 11.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.963 0.411 . . . . 74.43 110.938 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.634 ' HE3' HG21 ' A' ' 57' ' ' ILE . 26.8 mtpp -94.08 149.64 21.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.114 -0.494 . . . . 75.43 110.937 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.408 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 1.7 t -132.55 118.99 37.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.294 -0.412 . . . . 72.35 111.126 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -87.49 134.22 33.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 74.45 110.898 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.591 ' CG ' HD22 ' A' ' 23' ' ' LEU . 68.5 m95 -124.32 168.17 13.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 73.4 110.893 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -152.86 133.54 13.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.246 -0.434 . . . . 75.54 110.866 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -42.89 111.02 0.22 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.253 -0.43 . . . . 73.31 110.888 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 31' ' ' ARG . 37.0 ptt85 -52.36 -19.32 2.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 72.32 110.844 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.16 10.81 3.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.181 -0.463 . . . . 73.05 110.895 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.42 ' NE2' ' HB2' ' A' ' 48' ' ' ALA . 2.4 pp0? -68.75 -8.41 42.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 64.11 110.88 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.42 ' HB2' ' NE2' ' A' ' 47' ' ' GLN . . . -95.81 -43.95 7.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 71.55 111.067 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -93.38 -47.83 6.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 45.1 110.848 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.418 HD13 ' CG ' ' A' ' 71' ' ' HIS . 29.5 mt -88.93 -12.48 41.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 55.13 110.922 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 70.59 -0.51 26.51 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.789 -0.72 . . . . 71.43 112.484 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.403 ' O ' ' CB ' ' A' ' 47' ' ' GLN . 32.9 t -47.2 144.76 2.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.824 0.345 . . . . 60.34 110.884 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -125.07 19.29 8.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 72.32 110.895 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.418 ' HB3' ' CE1' ' A' ' 69' ' ' HIS . 32.3 t -66.86 111.64 3.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 72.21 110.862 -179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -109.98 145.19 37.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.107 -0.497 . . . . 74.31 110.934 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.583 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -137.37 154.93 49.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.22 -0.445 . . . . 62.02 111.029 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.634 HG21 ' HE3' ' A' ' 39' ' ' LYS . 75.7 mt -111.33 135.12 51.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 74.5 111.103 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.6 p -117.84 128.76 55.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 61.55 111.18 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.405 ' CG ' ' HG2' ' A' ' 39' ' ' LYS . 9.8 mt-30 -131.81 95.1 3.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.211 -0.45 . . . . 71.2 110.85 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 87.4 -95.44 2.08 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.74 -0.743 . . . . 65.34 112.502 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.516 ' CD2' ' HA ' ' A' ' 10' ' ' PRO . 1.4 t60 -127.09 0.23 6.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.797 0.332 . . . . 72.31 110.882 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.715 ' CG ' HD12 ' A' ' 8' ' ' LEU . 15.3 mmm-85 -104.18 -179.26 3.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 63.24 110.814 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.817 HD13 ' CG ' ' A' ' 25' ' ' HIS . 17.6 tt -150.3 160.57 4.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 72.4 111.147 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.583 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 4.5 mpp? -137.65 140.99 41.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 71.45 110.896 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 92.6 t -102.7 127.9 56.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 71.43 111.113 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 18.7 mtm -105.16 -16.59 14.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.158 -0.474 . . . . 74.14 110.865 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -154.49 160.28 41.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.215 -0.448 . . . . 75.41 110.851 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 88.2 p -90.09 179.25 5.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 62.44 110.831 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.486 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 38.4 m-70 -116.5 134.28 55.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.089 -0.505 . . . . 64.54 110.881 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 45.4 t -85.85 4.94 34.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 44.31 110.854 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.418 ' CG ' HD13 ' A' ' 50' ' ' LEU . 28.2 p80 -131.6 163.97 26.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.454 . . . . 74.32 110.869 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 16.4 mp0 -100.82 149.21 35.99 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.617 0.722 . . . . 73.11 110.898 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.49 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 54.3 Cg_endo -69.71 156.47 63.39 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.692 2.261 . . . . 62.15 112.395 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.93 95.69 3.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.233 -0.439 . . . . 71.4 110.885 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 mt -57.06 -14.82 4.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 64.32 110.924 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -74.47 -46.26 40.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.249 -0.432 . . . . 63.1 111.148 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.67 -31.57 40.11 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.686 -0.768 . . . . 62.42 112.508 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -70.66 -42.49 70.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.786 0.327 . . . . 64.51 110.964 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -64.56 -35.76 82.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 71.52 110.934 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.37 -37.98 79.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 70.4 111.083 179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.3 mt -69.94 -22.58 63.17 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.272 -0.422 . . . . 75.33 110.916 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.685 ' NH2' HG11 ' A' ' 24' ' ' VAL . 35.7 mtt180 -89.02 -25.26 22.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 72.15 110.891 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -77.02 -27.11 54.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 73.12 110.954 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.3 ptp180 -73.48 -25.76 60.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 75.53 110.838 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.52 -50.36 12.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.145 -0.479 . . . . 70.13 110.936 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.85 175.88 8.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.129 -0.487 . . . . 72.02 110.896 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.445 HD23 ' C ' ' A' ' 87' ' ' LEU . 4.9 tt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 70.43 110.932 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.471 -0.252 . . . . 53.4 112.471 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.6 t -123.75 75.34 1.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.869 0.366 . . . . 73.4 110.875 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.2 m -99.04 -55.31 2.74 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 54.2 110.896 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 59.15 -103.57 0.41 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.707 -0.759 . . . . 73.12 112.525 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 43.3 t -87.01 138.97 31.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.85 0.357 . . . . 72.24 110.801 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.2 m -77.19 167.22 22.12 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.479 . . . . 73.41 110.846 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 112.04 22.17 6.03 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.701 -0.761 . . . . 54.14 112.482 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.0 tp -77.96 99.52 6.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.801 0.334 . . . . 71.35 110.948 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -78.4 146.71 70.74 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.619 0.723 . . . . 74.12 110.868 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 -169.02 0.3 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.678 2.252 . . . . 62.01 112.312 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.976 HD21 HD11 ' A' ' 23' ' ' LEU . 11.1 tp -157.89 148.33 20.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.44 110.892 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.406 ' CD ' ' NH1' ' A' ' 82' ' ' ARG . 24.8 tt0 -104.51 144.45 31.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 74.32 110.916 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.405 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 20.4 m-85 -140.03 171.92 13.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 65.22 110.85 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.675 HD11 ' CD ' ' A' ' 82' ' ' ARG . 6.2 mt -144.21 155.82 44.04 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.095 -0.502 . . . . 73.14 110.973 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -116.8 141.38 48.29 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.194 -0.457 . . . . 72.4 110.822 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 9.0 p -112.6 173.17 6.5 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 72.33 111.149 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 80.8 p -108.76 -36.18 6.21 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.222 -0.445 . . . . 65.32 110.851 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.7 mt -91.85 -47.61 7.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.12 -0.491 . . . . 71.31 110.908 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -82.85 -112.42 0.49 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.719 -0.753 . . . . 73.0 112.486 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -149.24 -103.89 0.3 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.746 -0.74 . . . . 41.31 112.497 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.2 ttm180 -121.81 156.75 32.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.91 0.386 . . . . 74.52 110.822 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -129.26 158.6 38.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 65.35 110.868 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.976 HD11 HD21 ' A' ' 11' ' ' LEU . 11.1 tp -123.18 116.12 22.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.121 -0.49 . . . . 73.34 110.897 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.53 116.19 31.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.151 -0.477 . . . . 75.12 111.152 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.809 ' CG ' HD13 ' A' ' 63' ' ' ILE . 10.5 t60 -152.29 126.73 9.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 63.31 110.874 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 62.29 42.79 8.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.26 -0.427 . . . . 63.34 110.914 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.7 m 55.22 27.73 10.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.13 -0.487 . . . . 73.43 110.847 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -125.99 -176.49 3.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 73.44 110.893 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 19.4 mt -135.33 131.99 37.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 72.04 110.895 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.515 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -126.7 168.77 13.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.473 . . . . 75.22 110.968 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.451 ' CZ ' ' HB3' ' A' ' 31' ' ' ARG . 0.2 OUTLIER -127.97 138.92 52.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 54.53 110.888 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.501 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 33.6 tttp -63.2 112.38 2.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.179 -0.464 . . . . 74.14 110.936 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -86.73 -58.39 2.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.194 -0.457 . . . . 72.44 110.921 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.5 pttm -146.88 -177.58 5.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.145 -0.48 . . . . 74.23 110.864 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -144.41 121.83 11.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 75.43 111.184 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.5 51.11 2.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 62.21 111.121 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.94 -59.8 3.05 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.799 -0.715 . . . . 64.22 112.501 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.413 ' N ' ' CD ' ' A' ' 38' ' ' GLU . 13.5 mp0 -112.91 -30.19 7.12 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.896 0.379 . . . . 75.14 110.861 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.515 ' NZ ' HG21 ' A' ' 57' ' ' ILE . 18.4 mtpp -94.1 153.77 17.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 74.22 110.872 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.2 t -129.24 115.34 35.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.267 -0.424 . . . . 74.34 111.144 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -80.76 144.21 32.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 73.1 110.898 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.501 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 72.0 m95 -135.04 163.22 30.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.116 -0.493 . . . . 74.41 110.902 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.9 ptt? -148.19 131.59 16.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 62.15 110.932 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.0 t -42.31 115.31 0.67 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.289 -0.414 . . . . 65.11 110.812 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 39.4 ptt85 -50.5 -18.96 0.75 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.17 -0.468 . . . . 73.4 110.886 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.692 ' CB ' HD12 ' A' ' 50' ' ' LEU . 6.2 m-20 -88.26 32.06 0.78 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.461 . . . . 74.43 110.87 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.618 ' H ' ' NE2' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -84.6 -14.53 48.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 73.0 110.865 -179.891 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.436 ' HB2' ' OE1' ' A' ' 47' ' ' GLN . . . -97.04 -46.3 6.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 61.54 111.133 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.1 ttt180 -84.48 -55.23 4.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.196 -0.456 . . . . 75.34 110.82 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.692 HD12 ' CB ' ' A' ' 46' ' ' ASP . 64.6 mt -88.07 9.56 22.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.289 -0.414 . . . . 74.53 110.957 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.8 35.48 2.18 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.746 -0.74 . . . . 62.52 112.47 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.423 ' N ' ' HA ' ' A' ' 47' ' ' GLN . 32.2 t -78.5 125.52 29.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.787 0.327 . . . . 70.31 110.878 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.65 19.31 18.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 63.14 110.863 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.7 t -69.64 125.67 27.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 64.34 110.855 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -122.48 159.52 27.48 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.164 -0.471 . . . . 54.14 110.91 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.561 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -151.74 149.48 29.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 35.14 111.075 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.515 HG21 ' NZ ' ' A' ' 39' ' ' LYS . 61.4 mt -117.7 131.08 71.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 74.11 111.139 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.639 HG22 HG13 ' A' ' 63' ' ' ILE . 30.1 p -115.66 144.69 43.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.161 -0.472 . . . . 64.24 111.217 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -130.39 94.66 3.71 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 72.12 110.96 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 78.55 -85.65 1.15 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.78 -0.724 . . . . 60.3 112.489 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -128.07 5.29 5.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.768 0.318 . . . . 55.2 110.854 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -102.8 176.98 4.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.206 -0.452 . . . . 73.22 110.835 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.809 HD13 ' CG ' ' A' ' 25' ' ' HIS . 18.3 tt -150.79 149.82 13.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.126 -0.488 . . . . 74.2 111.115 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.561 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 53.7 mtm -138.27 140.12 39.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.154 -0.475 . . . . 75.12 110.862 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.401 ' CG2' ' NE2' ' A' ' 25' ' ' HIS . 66.8 t -99.43 142.21 15.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.195 -0.457 . . . . 71.21 111.101 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 29.0 mmm -103.4 -62.25 1.31 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.172 -0.467 . . . . 65.23 110.926 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 83.2 mtt180 -114.99 -175.75 2.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.305 -0.407 . . . . 64.51 110.882 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 20.7 p -96.91 -175.57 3.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 74.24 110.892 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.453 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 69.5 m-70 -117.74 135.31 54.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 53.42 110.866 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.3 t -90.1 14.94 11.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 63.13 110.927 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.578 ' CG ' HD13 ' A' ' 50' ' ' LEU . 25.2 p80 -143.36 162.29 36.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 75.33 110.829 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 72.1 mm-40 -93.59 152.84 41.17 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.645 0.736 . . . . 71.33 110.874 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 154.92 67.18 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.702 2.268 . . . . 72.3 112.375 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.26 82.34 2.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.245 -0.434 . . . . 75.14 110.897 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.1 mt -53.79 -16.32 1.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 73.04 110.906 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.05 -52.6 13.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 53.02 111.102 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.9 -30.11 64.03 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.666 -0.778 . . . . 65.3 112.442 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.6 tp -73.03 -46.06 54.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.86 0.362 . . . . 64.4 110.922 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -60.57 -36.51 78.67 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.216 -0.447 . . . . 65.42 110.837 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -57.47 -32.11 66.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.162 -0.472 . . . . 62.23 111.115 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.6 mt -73.57 -42.69 61.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.209 -0.45 . . . . 74.42 110.903 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.675 ' CD ' HD11 ' A' ' 14' ' ' LEU . 1.6 mpp_? -76.49 -20.68 56.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 70.41 110.865 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -86.98 -38.15 16.89 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 65.41 110.963 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.28 -7.29 58.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 74.22 110.839 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -92.28 -64.15 1.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.201 -0.454 . . . . 71.12 110.829 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 32.2 mtp180 -65.03 174.53 1.91 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 42.11 110.909 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.719 HD13 ' C ' ' A' ' 87' ' ' LEU . 2.5 tm? . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.169 -0.469 . . . . 75.31 110.898 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.277 0 N-CA-C 112.457 -0.257 . . . . 61.0 112.457 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.0 t -133.7 160.27 38.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.838 0.352 . . . . 74.13 110.833 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.9 m -122.87 100.38 6.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 72.54 110.821 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.65 -123.67 5.31 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.761 -0.733 . . . . 62.23 112.453 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.5 m -136.16 149.14 48.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.843 0.354 . . . . 51.51 110.874 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 97.0 p -101.21 -179.86 4.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.127 -0.488 . . . . 71.32 110.881 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.89 -116.03 0.7 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.727 -0.749 . . . . 64.34 112.471 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.454 ' CD1' ' HB3' ' A' ' 62' ' ' ARG . 3.4 tp -113.7 101.61 9.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.806 0.336 . . . . 64.25 110.932 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.42 ' CD ' ' HD2' ' A' ' 10' ' ' PRO . 0.0 OUTLIER -75.22 144.5 78.73 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.605 0.717 . . . . 74.42 110.832 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.42 ' HD2' ' CD ' ' A' ' 9' ' ' ARG . 53.6 Cg_endo -69.72 -166.71 0.19 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.679 2.253 . . . . 44.21 112.338 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.659 HD21 HD11 ' A' ' 23' ' ' LEU . 11.7 tp -158.05 145.61 18.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 72.23 110.853 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -104.47 136.24 44.4 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.131 -0.486 . . . . 63.22 110.902 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.438 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 94.4 m-85 -126.85 163.4 23.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.227 -0.442 . . . . 73.24 110.904 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.8 HD12 ' CG2' ' A' ' 24' ' ' VAL . 1.4 mt -148.9 153.31 37.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.136 -0.483 . . . . 71.12 110.893 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.0 ppt_? -127.85 149.91 50.08 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.141 -0.481 . . . . 73.15 110.84 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.98 HG23 ' O ' ' A' ' 20' ' ' GLY . 2.3 p -107.21 -176.12 2.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 44.23 111.182 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.76 ' CB ' HD23 ' A' ' 18' ' ' LEU . 49.2 m -34.79 -75.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 74.44 110.848 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.76 HD23 ' CB ' ' A' ' 17' ' ' SER . 0.2 OUTLIER -131.3 139.98 49.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 72.03 110.928 179.99 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.428 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 35.83 68.46 0.28 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.723 -0.751 . . . . 63.24 112.506 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.98 ' O ' HG23 ' A' ' 16' ' ' THR . . . -157.23 75.57 0.21 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.755 -0.736 . . . . 75.51 112.444 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 12.1 tpp180 -96.5 116.93 29.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.738 0.304 . . . . 73.25 110.916 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -99.0 168.93 9.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 73.53 110.914 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.659 HD11 HD21 ' A' ' 11' ' ' LEU . 7.9 tp -123.85 114.13 19.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.112 -0.494 . . . . 72.43 110.894 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.8 ' CG2' HD12 ' A' ' 14' ' ' LEU . 43.0 t -90.74 110.75 22.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.45 . . . . 73.23 111.106 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.95 ' CG ' HD13 ' A' ' 63' ' ' ILE . 32.6 t60 -147.65 125.07 11.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 72.24 110.868 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 63.24 38.41 10.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.243 -0.435 . . . . 70.54 110.863 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.578 ' OG ' HD23 ' A' ' 75' ' ' LEU . 22.2 t 62.6 15.41 7.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 62.33 110.898 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -112.59 177.58 4.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.115 -0.493 . . . . 75.14 110.884 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.444 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 44.6 mt -132.46 129.7 39.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 55.04 110.927 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.499 ' HB2' HD23 ' A' ' 23' ' ' LEU . 1.2 m-85 -124.53 175.4 7.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 73.21 110.897 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 30.0 mtp180 -133.47 139.22 46.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 74.15 110.852 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -64.75 111.14 2.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 73.31 110.93 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -86.96 -57.91 2.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.248 -0.433 . . . . 75.51 110.909 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.75 167.89 27.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 54.13 110.881 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -127.38 131.61 50.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.224 -0.444 . . . . 61.32 111.093 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -117.71 100.05 7.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 62.05 111.129 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.33 -96.44 0.2 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.705 -0.76 . . . . 65.41 112.431 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -113.55 2.34 15.3 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.91 0.386 . . . . 72.43 110.896 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -105.07 157.6 17.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.484 . . . . 75.5 110.847 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.5 t -136.66 116.67 16.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 44.2 111.137 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -79.09 146.71 33.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 73.51 110.956 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.509 ' CG ' HD22 ' A' ' 23' ' ' LEU . 69.1 m95 -136.51 167.38 21.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.145 -0.479 . . . . 71.31 110.981 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 13.6 ptt? -152.52 132.64 13.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.262 -0.427 . . . . 71.04 110.86 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -45.43 113.93 0.67 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.215 -0.448 . . . . 73.44 110.893 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.448 ' NH2' HD11 ' A' ' 81' ' ' LEU . 18.0 ptt180 -54.89 -28.74 52.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.465 . . . . 73.4 110.87 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.47 48.19 1.54 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.174 -0.466 . . . . 41.53 110.866 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -84.76 -37.04 21.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 74.13 110.95 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.17 -12.9 29.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 72.22 111.078 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.94 -40.99 7.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 72.53 110.855 -179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.641 HD13 ' CG ' ' A' ' 71' ' ' HIS . 90.3 mt -114.76 23.99 12.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 71.23 110.886 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.96 53.14 0.86 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.707 -0.759 . . . . 73.51 112.5 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -125.61 118.45 25.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.86 0.362 . . . . 75.44 110.897 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.8 mmt85 -105.58 50.23 0.78 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 73.33 110.815 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.3 t -87.33 117.26 25.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.47 . . . . 74.12 110.806 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -105.15 161.55 14.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.141 -0.481 . . . . 73.44 110.902 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.782 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -148.08 163.01 38.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.218 -0.447 . . . . 64.15 111.059 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 70.2 mt -127.32 127.79 69.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.219 -0.446 . . . . 74.33 111.117 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.644 HG22 HG13 ' A' ' 63' ' ' ILE . 42.1 p -110.94 144.31 40.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 73.32 111.191 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -128.46 90.29 3.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.288 -0.415 . . . . 74.03 110.995 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.95 -86.73 0.97 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.732 -0.747 . . . . 61.31 112.456 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.461 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.5 OUTLIER -124.68 7.87 8.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.771 0.32 . . . . 73.12 110.854 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.454 ' HB3' ' CD1' ' A' ' 8' ' ' LEU . 10.3 ptt180 -105.82 180.0 4.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 72.34 110.831 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.95 HD13 ' CG ' ' A' ' 25' ' ' HIS . 17.5 tt -151.0 153.8 9.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 65.4 111.166 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.782 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 30.3 ttp -144.3 147.1 33.07 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 63.32 110.924 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 t -116.88 145.69 22.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.235 -0.439 . . . . 71.31 111.125 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 2.4 mtt -112.38 -62.31 1.59 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 72.3 110.871 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 -96.32 177.48 5.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.277 -0.42 . . . . 63.44 110.836 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.7 m -100.64 174.02 6.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 65.42 110.819 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.411 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 74.4 m-70 -107.88 127.69 53.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.117 -0.492 . . . . 73.21 110.85 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 8.2 t -82.53 14.74 2.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.182 -0.463 . . . . 73.42 110.897 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.641 ' CG ' HD13 ' A' ' 50' ' ' LEU . 27.8 p80 -145.12 153.12 41.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 75.04 110.842 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -86.8 152.49 54.01 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.621 0.724 . . . . 64.42 110.89 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 152.85 69.54 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.676 2.251 . . . . 60.13 112.377 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -129.55 90.95 3.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.241 -0.436 . . . . 52.04 110.878 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.578 HD23 ' OG ' ' A' ' 27' ' ' SER . 18.8 mt -58.69 -31.13 67.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 54.2 110.92 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -68.58 -31.97 71.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 63.21 111.153 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -88.54 -37.5 7.48 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.675 -0.774 . . . . 43.34 112.534 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.585 HD11 HG13 ' A' ' 24' ' ' VAL . 10.2 tp -72.6 -40.09 66.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.722 0.296 . . . . 72.13 110.892 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.567 ' N ' HH21 ' A' ' 82' ' ' ARG . 30.8 mm-40 -64.22 -30.35 71.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 63.22 110.867 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.412 ' O ' ' N ' ' A' ' 83' ' ' GLN . . . -65.12 -59.53 4.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.133 -0.485 . . . . 44.0 111.095 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.448 HD11 ' NH2' ' A' ' 45' ' ' ARG . 14.4 mt -39.47 -43.46 1.25 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.183 -0.462 . . . . 74.42 110.97 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.567 HH21 ' N ' ' A' ' 79' ' ' GLU . 55.6 mtm180 -65.29 -42.17 93.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.101 -0.5 . . . . 74.24 110.878 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.445 ' HG2' ' N ' ' A' ' 84' ' ' ARG . 2.1 pt20 -40.94 -33.65 0.33 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 71.23 110.962 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.445 ' N ' ' HG2' ' A' ' 83' ' ' GLN . 58.0 mtt180 -70.68 -45.55 64.84 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.199 -0.455 . . . . 73.34 110.852 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.23 -66.99 0.55 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.225 -0.443 . . . . 74.52 110.812 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.437 ' C ' ' CD ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -96.78 170.24 9.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 72.42 110.802 -179.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 14.0 tp . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 64.41 110.962 -179.987 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.493 -0.243 . . . . 33.03 112.493 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m 61.16 33.12 19.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.939 0.4 . . . . 70.21 110.871 -179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 11.4 t -119.58 65.01 0.8 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 53.11 110.911 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 111.41 95.56 2.29 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.808 -0.711 . . . . 72.51 112.511 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.6 p -138.43 119.81 14.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.886 0.374 . . . . 54.01 110.884 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 17.5 t -99.66 80.85 2.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 62.44 110.842 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 154.0 -43.95 0.59 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.684 -0.769 . . . . 54.52 112.428 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.408 ' CD1' ' HB3' ' A' ' 62' ' ' ARG . 28.3 tp -91.9 106.7 18.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.801 0.334 . . . . 63.01 110.965 -179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 86.9 mtt180 -81.29 145.77 56.58 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.561 0.696 . . . . 75.03 110.896 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 -165.25 0.15 Allowed 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.608 2.205 . . . . 71.13 112.294 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.869 HD21 HD11 ' A' ' 23' ' ' LEU . 25.9 tp -167.55 144.42 4.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 63.55 110.933 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.511 ' OE2' HG21 ' A' ' 24' ' ' VAL . 21.6 tt0 -102.32 150.0 23.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 73.34 110.908 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.436 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 37.1 m-85 -139.42 172.05 13.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.114 -0.494 . . . . 74.42 110.914 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.424 HD12 HD21 ' A' ' 29' ' ' LEU . 10.9 mt -144.45 151.78 39.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 73.04 110.94 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.4 ' HG2' ' CD ' ' A' ' 21' ' ' ARG . 79.1 mtm-85 -124.25 117.55 24.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.269 -0.423 . . . . 74.13 110.866 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.6 p -92.96 176.36 6.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 72.43 111.155 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 62.7 m -106.73 -68.99 0.85 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 64.34 110.839 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.6 mt -84.11 36.44 0.57 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 63.5 110.879 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.98 -105.85 0.3 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.743 -0.741 . . . . 72.23 112.451 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -162.64 -143.32 3.65 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.756 -0.735 . . . . 53.02 112.523 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.4 ' CD ' ' HG2' ' A' ' 15' ' ' ARG . 11.6 tpt180 -102.4 130.33 49.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.924 0.392 . . . . 74.24 110.842 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.434 ' HB3' HD22 ' A' ' 29' ' ' LEU . 2.7 m-85 -107.45 158.79 16.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 65.41 110.875 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.869 HD11 HD21 ' A' ' 11' ' ' LEU . 8.9 tp -125.1 114.64 19.31 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.16 -0.473 . . . . 73.35 110.91 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.511 HG21 ' OE2' ' A' ' 12' ' ' GLU . 53.5 t -87.96 119.46 35.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.206 -0.452 . . . . 74.15 111.124 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.915 ' CG ' HD13 ' A' ' 63' ' ' ILE . 25.2 t60 -156.45 126.17 6.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.247 -0.433 . . . . 71.44 110.937 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 61.53 41.07 12.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.234 -0.439 . . . . 75.03 110.87 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.413 ' HB2' ' CB ' ' A' ' 73' ' ' PRO . 10.3 m 58.37 32.44 22.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.091 -0.504 . . . . 74.31 110.858 -179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -131.41 -175.48 3.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 65.01 110.938 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.449 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 29.3 mt -140.63 133.23 28.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.206 -0.452 . . . . 74.3 110.886 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.51 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.1 m-85 -127.89 162.64 26.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 70.25 110.915 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.5 mtp180 -120.74 136.16 54.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 75.23 110.897 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.552 ' NZ ' ' HB2' ' A' ' 35' ' ' ALA . 38.5 tttp -58.66 112.07 1.49 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 62.43 110.97 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.44 ' OE1' ' NH2' ' A' ' 55' ' ' ARG . 1.6 tm-20 -82.87 -51.22 7.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.431 . . . . 73.1 110.937 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.57 ' HD3' ' CD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -158.52 179.12 9.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 74.34 110.898 179.935 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.552 ' HB2' ' NZ ' ' A' ' 32' ' ' LYS . . . -130.78 135.31 47.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 63.0 111.098 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -118.76 -172.58 2.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 51.01 111.111 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.25 92.12 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 74.24 112.478 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 66.71 43.24 2.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.917 0.389 . . . . 44.22 110.914 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -154.26 159.18 41.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 71.34 110.882 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 14.3 t -135.78 121.01 28.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 64.45 111.096 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.57 ' CD1' ' HD3' ' A' ' 34' ' ' LYS . 8.9 m-85 -85.39 149.12 25.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 75.23 110.914 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.437 ' CD1' HG23 ' A' ' 58' ' ' THR . 70.0 m95 -143.0 149.76 38.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 73.5 110.914 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 8.2 ptt? -135.36 130.83 35.57 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 71.15 110.913 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.432 ' O ' ' N ' ' A' ' 46' ' ' ASP . 2.2 t -46.59 107.56 0.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 73.13 110.861 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.449 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.7 ptt-85 -40.23 -27.28 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.171 -0.468 . . . . 72.2 110.843 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 44' ' ' CYS . 0.3 OUTLIER -88.8 40.52 0.98 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 71.24 110.845 -179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -86.43 -37.46 18.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.46 . . . . 73.52 110.909 -179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.62 -15.08 23.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 74.33 111.079 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.8 tpp180 -92.41 -61.93 1.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 63.34 110.89 -179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.1 mt -103.54 29.17 5.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 52.55 110.954 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.59 47.31 4.81 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.757 -0.735 . . . . 42.33 112.501 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 2.2 t -105.5 72.86 0.99 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.893 0.378 . . . . 65.33 110.931 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.474 ' HD3' ' N ' ' A' ' 54' ' ' SER . 0.0 OUTLIER -55.88 -13.88 2.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.12 -0.491 . . . . 75.4 110.828 -179.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.474 ' N ' ' HD3' ' A' ' 53' ' ' ARG . 3.4 t -35.55 122.72 0.64 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 54.45 110.89 -179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.44 ' NH2' ' OE1' ' A' ' 33' ' ' GLU . 37.5 mtp180 -118.71 177.06 4.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 71.5 110.876 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.413 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -161.62 151.4 16.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 53.52 111.091 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.794 HD12 ' CE ' ' A' ' 66' ' ' MET . 61.7 mt -121.84 133.63 67.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.46 . . . . 73.1 111.098 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.562 HG22 HG13 ' A' ' 63' ' ' ILE . 22.7 p -116.01 144.39 44.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 71.43 111.146 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -126.79 88.94 2.9 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 74.23 110.928 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 81.55 -86.92 1.39 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.711 -0.757 . . . . 72.33 112.417 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.42 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -126.03 8.12 7.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.752 0.31 . . . . 71.44 110.845 -179.885 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.411 ' HG3' ' N ' ' A' ' 63' ' ' ILE . 8.2 ptm180 -106.42 179.82 4.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 71.11 110.867 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.915 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.95 151.73 12.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.43 . . . . 65.24 111.162 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.433 ' N ' ' O ' ' A' ' 57' ' ' ILE . 3.9 mpp? -140.91 140.11 34.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 64.51 110.904 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.5 t -109.8 140.25 29.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.228 -0.442 . . . . 61.3 111.085 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.794 ' CE ' HD12 ' A' ' 57' ' ' ILE . 6.8 mmt -104.0 -53.78 2.68 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.153 -0.476 . . . . 73.21 110.864 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.3 mtp85 -115.05 167.67 10.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 74.41 110.93 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.0 m -86.54 -175.76 5.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 74.1 110.848 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 63.6 m-70 -118.85 137.3 53.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.17 -0.468 . . . . 64.5 110.841 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 16.6 t -91.29 9.99 29.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 51.2 110.786 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 33.0 p80 -138.23 157.3 46.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.247 -0.433 . . . . 75.33 110.916 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -89.96 156.49 46.81 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.599 0.714 . . . . 52.24 110.898 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.413 ' CB ' ' HB2' ' A' ' 27' ' ' SER . 54.0 Cg_endo -69.7 140.19 42.31 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.727 2.285 . . . . 61.34 112.335 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -102.53 80.95 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.245 -0.434 . . . . 71.03 110.903 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 57.2 mt -53.78 -16.47 1.74 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 62.34 110.963 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -88.22 -57.65 2.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.441 . . . . 53.04 111.073 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.79 -33.67 83.89 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.726 -0.749 . . . . 74.13 112.453 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.9 tp -70.53 -49.52 47.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.784 0.326 . . . . 75.42 110.936 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -62.24 -31.75 72.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 63.11 110.844 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.61 -54.57 22.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 73.1 111.063 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 15.8 mt -56.19 -32.39 64.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.236 -0.438 . . . . 60.44 110.928 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 6.5 mtp-105 -59.99 -36.04 76.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 75.22 110.917 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.414 ' HG3' ' N ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -57.48 -35.56 70.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.147 -0.478 . . . . 73.3 110.852 -179.902 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.458 ' CZ ' ' CB ' ' A' ' 84' ' ' ARG . 1.5 mtp-105 -69.66 -12.5 61.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 71.2 110.876 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 86' ' ' ARG . 2.6 tp10 -102.49 -52.64 3.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 62.11 110.933 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.42 ' N ' ' HG3' ' A' ' 85' ' ' GLU . 15.6 mmm180 -48.02 145.63 2.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.479 . . . . 63.32 110.867 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.73 ' C ' HD22 ' A' ' 87' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.225 -0.443 . . . . 71.54 110.88 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 112.495 -0.242 . . . . 54.54 112.495 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.5 t -72.01 145.79 48.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.888 0.375 . . . . 64.31 110.84 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 p -135.26 140.94 45.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.096 -0.502 . . . . 75.35 110.896 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.12 -178.61 36.15 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.711 -0.757 . . . . 70.51 112.455 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 t -93.53 155.57 17.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.814 0.34 . . . . 64.5 110.885 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 7.9 m -124.86 158.16 34.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 75.32 110.851 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 107.84 -106.43 2.39 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.767 -0.73 . . . . 53.42 112.461 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.541 HD12 ' HG3' ' A' ' 62' ' ' ARG . 6.0 tp -82.46 85.34 6.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.82 0.343 . . . . 72.31 110.94 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.466 ' N ' ' HD3' ' A' ' 62' ' ' ARG . 5.7 mtp-105 -75.87 144.13 75.73 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.526 0.679 . . . . 73.12 110.887 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.409 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 53.9 Cg_endo -69.68 -176.1 1.36 Allowed 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.669 2.246 . . . . 64.11 112.36 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.908 HD21 HD11 ' A' ' 23' ' ' LEU . 22.6 tp -135.12 154.06 51.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 60.22 110.925 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.468 ' C ' ' CD1' ' A' ' 13' ' ' PHE . 4.8 tp10 -118.57 150.03 40.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 72.14 110.881 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.756 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 1.9 m-85 -139.97 168.05 20.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 74.03 110.865 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.687 HD21 ' HG2' ' A' ' 82' ' ' ARG . 8.6 mt -135.26 117.24 15.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.17 -0.468 . . . . 72.41 110.896 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.3 ttt-85 -72.35 135.66 45.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 55.45 110.842 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.424 ' OG1' ' N ' ' A' ' 20' ' ' GLY . 1.1 p -116.58 168.13 10.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 61.21 111.122 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 8.3 t -107.87 -52.48 2.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.181 -0.463 . . . . 71.53 110.854 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.6 mt -66.65 -55.09 16.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.094 -0.503 . . . . 72.31 110.938 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -84.33 -103.77 0.59 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.746 -0.74 . . . . 74.45 112.445 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.424 ' N ' ' OG1' ' A' ' 16' ' ' THR . . . -155.38 -102.51 0.2 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.708 -0.758 . . . . 72.03 112.444 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.5 tpp85 -119.88 150.1 41.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.856 0.36 . . . . 74.34 110.848 -179.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -116.01 160.59 20.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.231 -0.441 . . . . 63.24 110.833 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.908 HD11 HD21 ' A' ' 11' ' ' LEU . 8.1 tp -122.63 113.89 19.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.065 -0.516 . . . . 73.22 110.908 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 88.8 t -88.6 117.57 32.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 73.53 111.115 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.77 ' CG ' HD13 ' A' ' 63' ' ' ILE . 8.4 t60 -153.22 124.88 7.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 70.3 110.889 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 62.17 45.3 7.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.278 -0.419 . . . . 32.22 110.909 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 53.61 21.95 2.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.139 -0.482 . . . . 70.24 110.831 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -119.57 -179.95 4.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.166 -0.47 . . . . 63.43 110.902 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' C ' ' CD1' ' A' ' 30' ' ' TYR . 43.6 mt -129.91 136.99 50.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 74.32 110.924 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.519 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -133.6 167.06 21.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.261 -0.427 . . . . 73.42 110.936 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.8 mtp180 -130.34 138.27 50.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 72.42 110.874 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 31.4 tttm -57.12 119.92 7.17 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.219 -0.446 . . . . 74.13 110.897 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -95.83 -55.09 3.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.282 -0.417 . . . . 74.14 110.876 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 45.5 pttt -151.13 178.68 8.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.107 -0.497 . . . . 75.33 110.864 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.02 121.21 15.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 54.11 111.19 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.4 56.74 3.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 63.14 111.094 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.31 -65.75 3.77 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.739 -0.743 . . . . 60.32 112.492 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -117.37 -20.87 8.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.883 0.373 . . . . 72.04 110.87 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.4 mtmm -93.4 161.32 14.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.168 -0.469 . . . . 75.04 110.937 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 t -137.03 116.12 15.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.29 -0.414 . . . . 74.21 111.12 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.435 ' CE2' HD11 ' A' ' 57' ' ' ILE . 6.3 m-85 -81.67 149.78 28.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 65.02 110.929 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.61 ' CG ' HD22 ' A' ' 23' ' ' LEU . 62.9 m95 -138.75 158.59 43.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.102 -0.499 . . . . 64.42 110.857 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 7.0 ptt? -142.24 137.97 31.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 73.31 110.867 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.41 ' C ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -46.42 108.39 0.14 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.207 -0.451 . . . . 74.4 110.906 -179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -44.4 -22.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.184 -0.462 . . . . 71.13 110.848 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.41 ' N ' ' C ' ' A' ' 44' ' ' CYS . 0.5 OUTLIER -84.09 35.79 0.54 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.438 . . . . 70.42 110.904 179.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -48.27 -65.28 0.59 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.182 -0.463 . . . . 54.35 110.941 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -92.56 -33.07 14.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.226 -0.443 . . . . 73.13 111.096 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.75 -46.2 70.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.235 -0.439 . . . . 61.21 110.928 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 58.7 mt -123.69 25.93 7.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 63.5 110.872 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 39.36 43.94 2.16 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.694 -0.765 . . . . 64.35 112.529 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.4 t -96.89 148.24 23.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.836 0.35 . . . . 74.32 110.854 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -132.79 33.91 3.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.182 -0.463 . . . . 73.24 110.902 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.409 ' HG ' ' CD2' ' A' ' 69' ' ' HIS . 32.5 t -84.9 118.18 24.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.198 -0.455 . . . . 73.43 110.854 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -112.29 146.55 38.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 64.42 110.837 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.652 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -137.41 157.33 46.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 64.2 111.139 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.435 HD11 ' CE2' ' A' ' 41' ' ' TYR . 84.7 mt -123.18 126.16 73.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.243 -0.435 . . . . 51.52 111.074 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.507 HG23 ' CD1' ' A' ' 42' ' ' TRP . 43.0 p -102.02 152.15 21.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.218 -0.446 . . . . 62.52 111.131 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.8 tm0? -154.61 108.03 2.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.197 -0.456 . . . . 73.45 110.87 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 74.02 -97.35 0.92 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.774 -0.727 . . . . 72.14 112.571 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.409 ' CD2' ' HA ' ' A' ' 10' ' ' PRO . 1.7 t60 -128.77 11.25 6.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.812 0.339 . . . . 74.55 110.81 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.541 ' HG3' HD12 ' A' ' 8' ' ' LEU . 11.0 mmm180 -117.63 176.4 5.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 75.33 110.863 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.77 HD13 ' CG ' ' A' ' 25' ' ' HIS . 21.2 tt -143.92 159.43 16.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.199 -0.455 . . . . 62.43 111.147 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.652 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 5.6 ttp -135.72 148.97 49.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 75.12 110.914 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.6 t -120.13 142.61 35.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 43.53 111.139 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.4 mtp -117.73 -63.48 1.42 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.173 -0.467 . . . . 62.2 110.888 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.1 mmp_? -89.61 171.24 9.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.165 -0.47 . . . . 74.32 110.809 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -103.44 174.04 6.04 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.102 -0.499 . . . . 73.12 110.841 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.449 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 62.2 m-70 -110.09 132.66 53.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.121 -0.49 . . . . 72.12 110.837 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 2.1 t -90.26 13.87 14.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 44.52 110.896 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -140.33 156.9 46.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 62.24 110.816 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -92.49 155.3 42.37 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 121.565 0.697 . . . . 51.42 110.883 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 162.23 42.87 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.659 2.239 . . . . 74.25 112.327 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -140.36 79.93 1.73 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 74.43 110.829 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 38.0 mt -46.35 -23.24 0.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 71.22 110.955 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.59 -40.93 72.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 45.13 111.111 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -80.44 -40.5 12.94 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.754 -0.736 . . . . 64.31 112.48 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.1 tp -65.77 -39.63 91.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.78 0.324 . . . . 54.14 110.909 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -63.64 -31.95 73.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 74.51 110.9 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.67 -31.57 72.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.119 -0.491 . . . . 75.34 111.097 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.47 HD23 ' CZ ' ' A' ' 84' ' ' ARG . 9.8 mt -79.35 -28.26 42.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.205 -0.452 . . . . 73.22 110.934 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.687 ' HG2' HD21 ' A' ' 14' ' ' LEU . 69.5 mtp180 -80.24 -35.19 36.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 74.45 110.84 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.416 ' HG3' ' N ' ' A' ' 84' ' ' ARG . 0.0 OUTLIER -59.45 -34.78 72.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.165 -0.47 . . . . 62.42 110.97 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.47 ' CZ ' HD23 ' A' ' 81' ' ' LEU . 10.1 ptt180 -83.92 -4.32 58.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.167 -0.469 . . . . 64.34 110.838 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -103.14 -30.24 10.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 75.43 110.857 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -103.55 73.41 1.19 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 72.24 110.879 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.8 tp . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.123 -0.49 . . . . 64.31 110.943 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 N-CA-C 112.5 -0.24 . . . . 73.2 112.5 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.4 p -120.25 116.1 24.91 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.954 0.407 . . . . 73.01 110.857 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.6 t -107.49 -16.13 14.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.09 -0.504 . . . . 70.11 110.834 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 151.89 -161.32 29.25 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.713 -0.756 . . . . 72.1 112.508 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.0 t -115.1 122.47 46.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.905 0.383 . . . . 53.03 110.802 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.2 t -122.08 164.83 17.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.086 -0.506 . . . . 71.51 110.857 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -68.63 -21.08 74.53 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.824 -0.703 . . . . 61.03 112.436 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.716 HD12 ' HG3' ' A' ' 62' ' ' ARG . 6.5 tp -71.14 88.77 0.81 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.852 0.358 . . . . 61.02 110.96 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.3 mtm180 -81.31 144.03 53.11 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.584 0.707 . . . . 74.4 110.85 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 178.82 4.16 Favored 'Trans proline' 0 C--O 1.233 0.226 0 C-N-CA 122.67 2.246 . . . . 72.34 112.382 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.95 HD21 HD11 ' A' ' 23' ' ' LEU . 20.7 tp -140.82 150.02 42.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.271 -0.422 . . . . 72.21 110.877 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -107.31 151.67 25.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.096 -0.502 . . . . 65.01 110.849 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.613 ' CE2' HD13 ' A' ' 23' ' ' LEU . 72.1 m-85 -137.22 172.96 12.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.121 -0.49 . . . . 75.45 110.83 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.493 HD12 HD21 ' A' ' 29' ' ' LEU . 16.6 mt -147.81 174.1 12.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.088 -0.506 . . . . 75.45 110.937 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -127.78 150.07 49.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 62.35 110.816 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.6 p -107.84 172.22 6.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.157 -0.474 . . . . 73.42 111.083 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.4 m -75.31 -65.87 0.84 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 62.23 110.824 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.511 ' N ' ' CD2' ' A' ' 18' ' ' LEU . 0.3 OUTLIER -68.24 71.15 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 75.33 110.932 -179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.439 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 34.72 83.94 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.745 -0.74 . . . . 61.44 112.533 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -158.75 170.91 35.34 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.751 -0.737 . . . . 71.51 112.5 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.407 ' CD ' ' O ' ' A' ' 14' ' ' LEU . 12.1 tpt180 -141.23 135.66 30.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.786 0.327 . . . . 54.22 110.916 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -107.42 158.67 16.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 62.43 110.936 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.95 HD11 HD21 ' A' ' 11' ' ' LEU . 13.1 tp -124.11 115.96 22.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.466 . . . . 74.21 110.935 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.3 t -90.35 115.51 29.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 64.01 111.086 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.877 ' CG ' HD13 ' A' ' 63' ' ' ILE . 29.7 t60 -153.49 132.77 12.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.137 -0.483 . . . . 74.31 110.809 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 60.02 33.16 21.32 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 75.44 110.967 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.8 m 65.43 29.23 11.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.119 -0.491 . . . . 52.54 110.909 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -130.74 -174.68 3.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.109 -0.496 . . . . 63.52 110.848 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.493 HD21 HD12 ' A' ' 14' ' ' LEU . 9.8 mt -138.86 132.7 30.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.108 -0.496 . . . . 74.05 110.967 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.522 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -125.96 166.92 16.04 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.19 -0.459 . . . . 75.1 110.973 179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -126.29 126.42 43.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.132 -0.486 . . . . 73.01 110.843 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -45.18 108.58 0.13 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.151 -0.477 . . . . 45.41 110.878 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -82.89 -53.41 5.88 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.16 -0.473 . . . . 71.3 110.927 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.466 ' HD3' ' CD1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -159.16 178.8 9.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.083 -0.508 . . . . 74.31 110.923 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -130.52 128.61 41.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.22 -0.446 . . . . 63.54 111.068 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.41 19.91 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 75.14 111.07 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 90.86 -49.65 3.1 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.731 -0.747 . . . . 51.23 112.472 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -111.32 -18.83 12.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.922 0.391 . . . . 71.21 110.866 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.464 ' HB3' ' CG2' ' A' ' 57' ' ' ILE . 9.9 mtmm -123.02 170.64 9.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.236 -0.438 . . . . 73.54 110.938 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.441 ' O ' ' CD1' ' A' ' 42' ' ' TRP . 4.7 t -133.53 119.13 33.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.236 -0.438 . . . . 65.53 111.114 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.466 ' CD1' ' HD3' ' A' ' 34' ' ' LYS . 2.9 m-85 -75.79 150.3 37.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.113 -0.494 . . . . 74.42 110.922 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.734 ' CD1' HG23 ' A' ' 58' ' ' THR . 75.3 m95 -142.92 121.96 12.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.106 -0.497 . . . . 64.3 110.892 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 16.3 ptt? -106.26 136.06 46.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.239 -0.437 . . . . 44.25 110.877 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.6 t -50.4 113.86 0.98 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.449 . . . . 74.14 110.924 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.43 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 20.7 ptt-85 -44.66 -35.16 2.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 74.23 110.927 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.69 44.31 0.62 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 74.42 110.902 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -88.77 -26.18 21.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 75.44 110.914 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.77 -30.72 12.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.199 -0.455 . . . . 55.31 111.106 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.442 ' CZ ' ' HB3' ' A' ' 49' ' ' ARG . 4.5 ttp-105 -89.04 -62.34 1.51 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 70.04 110.855 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 88.5 mt -90.37 20.31 4.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 62.21 110.867 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 36.72 36.88 0.19 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.721 -0.752 . . . . 44.12 112.512 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.7 t -89.33 120.67 30.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.791 0.329 . . . . 74.44 110.877 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 40.8 mmm-85 -98.75 13.75 31.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.456 . . . . 73.23 110.857 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.507 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 23.2 t -61.26 108.21 0.88 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 74.54 110.94 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.43 ' CB ' ' CZ ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -111.08 164.33 12.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 70.01 110.868 -179.897 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.735 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -157.23 159.93 38.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.42 111.13 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.464 ' CG2' ' HB3' ' A' ' 39' ' ' LYS . 74.6 mt -123.98 128.49 74.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.234 -0.439 . . . . 72.31 111.16 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.734 HG23 ' CD1' ' A' ' 42' ' ' TRP . 30.0 p -101.29 144.21 30.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 54.34 111.14 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -142.56 111.02 6.13 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 73.43 110.88 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 68.73 -94.77 0.36 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.717 -0.754 . . . . 64.32 112.505 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.479 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -128.68 7.28 5.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.832 0.348 . . . . 75.13 110.894 -179.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.716 ' HG3' HD12 ' A' ' 8' ' ' LEU . 10.3 mmm180 -112.41 178.82 4.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 64.11 110.872 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.877 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.2 tt -145.74 157.87 12.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 73.24 111.172 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.735 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 2.7 ttp -135.31 140.66 45.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 54.05 110.804 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 61.1 t -106.37 143.22 17.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 62.13 111.162 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.0 mtp -117.96 -55.21 2.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.23 -0.441 . . . . 74.44 110.897 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 11.4 mmt180 -110.75 144.91 38.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.261 -0.427 . . . . 74.31 110.828 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.3 p -75.39 168.71 19.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 74.44 110.783 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.507 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 72.6 m-70 -104.5 132.75 50.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.099 -0.5 . . . . 74.05 110.833 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.6 t -86.21 11.95 10.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.196 -0.456 . . . . 55.43 110.853 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 25.9 p80 -140.2 154.96 47.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 74.45 110.858 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -89.52 152.36 47.17 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.67 0.747 . . . . 72.54 110.878 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 159.58 52.86 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.665 2.243 . . . . 71.22 112.365 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -139.48 85.68 2.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.203 -0.453 . . . . 44.22 110.892 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.2 mt -52.34 -18.17 1.48 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.187 -0.46 . . . . 65.42 110.918 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.6 -52.28 13.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 73.51 111.099 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -70.98 -34.96 64.94 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.666 -0.778 . . . . 21.24 112.571 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 11.1 tp -68.55 -42.04 78.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.802 0.334 . . . . 73.33 110.937 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.57 -40.81 97.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.174 -0.466 . . . . 64.32 110.891 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -55.95 -28.45 57.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 73.24 111.102 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.2 mt -81.59 -29.65 33.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 74.4 110.943 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 41.4 mtp180 -82.38 -31.63 29.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.16 -0.473 . . . . 61.42 110.901 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.09 -34.24 71.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 61.43 110.911 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -75.97 -8.49 57.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.171 -0.468 . . . . 75.21 110.833 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.408 ' HG3' ' CD2' ' A' ' 14' ' ' LEU . 3.8 mm-40 -94.81 -52.09 4.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.22 -0.445 . . . . 73.41 110.895 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 8.5 mtp-105 -78.06 141.05 39.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 63.54 110.906 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.79 ' C ' HD22 ' A' ' 87' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.202 -0.454 . . . . 72.14 110.907 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.515 -0.234 . . . . 24.3 112.515 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.4 p -129.25 97.57 4.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.924 0.392 . . . . 61.12 110.829 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 69.8 m -143.0 137.03 29.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.127 -0.488 . . . . 70.22 110.819 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.94 167.2 25.15 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.705 -0.76 . . . . 53.11 112.443 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.7 m -135.69 126.19 26.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.806 0.336 . . . . 74.33 110.878 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 16.0 p -136.67 144.09 43.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.177 -0.465 . . . . 51.32 110.868 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.36 19.48 42.56 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.75 -0.738 . . . . 73.14 112.426 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.853 HD23 ' O ' ' A' ' 8' ' ' LEU . 3.5 tt -143.48 105.42 4.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.859 0.361 . . . . 73.12 110.902 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 mmt-85 -76.53 144.04 73.17 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.614 0.721 . . . . 72.12 110.905 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.445 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 53.6 Cg_endo -69.7 -179.5 2.93 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.744 2.296 . . . . 51.41 112.314 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.758 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 23.7 tp -123.44 145.75 48.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 73.4 110.909 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -91.66 136.71 32.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 71.33 110.857 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.758 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 68.3 m-85 -136.82 169.65 17.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 73.43 110.898 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.418 HD21 ' HG2' ' A' ' 82' ' ' ARG . 12.8 mt -143.92 120.99 11.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.106 -0.497 . . . . 64.3 110.931 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -92.41 129.32 38.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.441 . . . . 62.41 110.881 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.455 HG21 ' CE2' ' A' ' 22' ' ' PHE . 1.2 p -108.62 165.55 11.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 60.52 111.125 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.8 m -107.3 -29.74 9.12 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.211 -0.449 . . . . 75.14 110.862 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.3 mp -85.86 -60.43 2.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.138 -0.483 . . . . 71.3 110.882 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.45 -91.18 0.35 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.741 -0.742 . . . . 74.42 112.477 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -168.91 -113.56 0.29 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.688 -0.768 . . . . 74.42 112.468 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.1 ttp180 -109.85 150.86 27.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.798 0.333 . . . . 74.03 110.852 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.455 ' CE2' HG21 ' A' ' 16' ' ' THR . 3.3 m-85 -129.25 166.04 20.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 74.23 110.88 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.636 HD11 HD21 ' A' ' 11' ' ' LEU . 5.0 tp -133.18 113.42 12.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.171 -0.468 . . . . 52.54 110.91 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 50.4 t -88.06 119.53 35.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.47 . . . . 65.24 111.164 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.646 ' CG ' HD13 ' A' ' 63' ' ' ILE . 4.7 t60 -155.85 132.38 10.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 75.32 110.821 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 58.19 36.72 26.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.282 -0.417 . . . . 64.5 110.851 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 m 62.23 26.07 15.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 53.25 110.822 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -126.29 -178.63 4.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 74.04 110.923 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.528 ' CD1' ' CZ ' ' A' ' 45' ' ' ARG . 67.8 mt -132.75 136.19 46.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.477 . . . . 72.42 110.926 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 0.9 OUTLIER -130.46 159.46 36.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 70.21 110.878 -179.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.458 ' NE ' ' HA ' ' A' ' 45' ' ' ARG . 3.0 mtt180 -113.96 136.81 52.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.102 -0.499 . . . . 75.44 110.881 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 61.4 tttt -61.28 108.67 0.96 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 64.52 110.892 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -81.01 -60.06 2.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.278 -0.419 . . . . 71.11 110.89 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 26.8 pttt -153.0 177.71 10.49 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 74.54 110.888 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -138.49 117.57 12.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.441 . . . . 64.12 111.134 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.8 91.75 4.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 34.12 111.142 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.25 -85.84 0.1 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.73 -0.748 . . . . 74.23 112.539 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -117.26 0.17 12.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.91 0.386 . . . . 74.13 110.879 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.623 ' HE3' HG21 ' A' ' 57' ' ' ILE . 55.8 mtpt -102.94 156.77 17.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.174 -0.466 . . . . 74.44 110.893 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.5 t -138.25 117.6 14.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.267 -0.424 . . . . 42.04 111.126 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.786 ' CE2' HD11 ' A' ' 57' ' ' ILE . 9.1 m-85 -82.07 146.64 29.54 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 74.15 110.952 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.559 ' CG ' HD22 ' A' ' 23' ' ' LEU . 71.8 m95 -137.3 159.64 41.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.13 -0.486 . . . . 75.22 110.904 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.1 ptt? -143.64 126.13 15.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 72.31 110.908 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -38.16 114.11 0.33 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.271 -0.422 . . . . 62.32 110.871 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.528 ' CZ ' ' CD1' ' A' ' 29' ' ' LEU . 20.2 ptt180 -52.64 -22.57 5.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 71.04 110.864 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.56 43.32 1.02 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 72.42 110.867 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -85.86 -35.51 20.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.456 . . . . 72.33 110.885 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.6 -9.3 27.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 45.15 111.103 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.4 ttm-85 -98.29 -54.7 2.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 74.24 110.864 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.3 mt -110.05 26.46 10.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 71.24 110.886 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.14 47.38 4.33 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.757 -0.735 . . . . 64.42 112.494 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.1 t -94.94 147.08 23.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.747 0.308 . . . . 72.14 110.918 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.406 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -132.07 26.65 4.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 74.44 110.857 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.0 t -78.07 109.53 12.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 73.51 110.828 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.406 ' NH1' ' HB2' ' A' ' 53' ' ' ARG . 9.7 mpt_? -103.75 158.29 16.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.33 110.915 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.49 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -149.13 161.39 42.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.193 -0.458 . . . . 75.44 111.064 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.786 HD11 ' CE2' ' A' ' 41' ' ' TYR . 40.6 mt -127.19 121.57 57.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 55.01 111.12 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 65.5 p -102.58 143.71 31.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.121 -0.49 . . . . 73.13 111.127 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -129.25 87.05 2.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.243 -0.435 . . . . 70.21 110.944 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.81 -82.26 1.09 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.742 -0.742 . . . . 73.04 112.509 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.683 ' HB2' HD21 ' A' ' 8' ' ' LEU . 3.5 m-70 -127.75 9.59 6.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.709 0.29 . . . . 65.41 110.794 -179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -111.68 170.49 8.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.169 -0.468 . . . . 63.03 110.896 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.646 HD13 ' CG ' ' A' ' 25' ' ' HIS . 5.7 tt -148.13 145.46 18.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.2 -0.454 . . . . 72.21 111.139 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.49 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 4.0 mpp? -132.7 133.31 43.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.158 -0.474 . . . . 71.33 110.897 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 57.2 t -104.45 130.0 55.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.284 -0.416 . . . . 73.23 111.082 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.443 ' CE ' HD12 ' A' ' 57' ' ' ILE . 10.4 mmt -102.46 -62.82 1.22 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.104 -0.498 . . . . 61.3 110.858 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.21 172.93 8.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.272 -0.422 . . . . 72.41 110.842 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.3 m -106.24 168.07 9.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 53.0 110.919 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.425 ' CE1' ' OH ' ' A' ' 30' ' ' TYR . 48.0 m-70 -105.19 130.98 53.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 72.32 110.899 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.9 t -88.51 11.93 15.84 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.208 -0.451 . . . . 41.54 110.877 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 25.4 p80 -137.48 161.0 37.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 63.21 110.827 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -97.22 151.95 37.99 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.55 0.691 . . . . 75.41 110.963 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 154.08 68.29 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.699 2.266 . . . . 61.51 112.369 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -131.36 79.67 1.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.182 -0.463 . . . . 72.01 110.845 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.6 mt -44.18 -23.43 0.1 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.868 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.99 -47.82 67.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.207 -0.451 . . . . 61.14 111.138 179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.52 -35.58 59.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.704 -0.76 . . . . 73.04 112.548 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -71.01 -35.35 72.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.727 0.299 . . . . 62.13 110.906 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -74.6 -25.05 59.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.18 -0.463 . . . . 75.41 110.879 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.93 -31.09 69.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 74.44 111.087 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.0 mt -86.39 -32.05 21.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.266 -0.424 . . . . 54.02 110.92 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.418 ' HG2' HD21 ' A' ' 14' ' ' LEU . 3.6 mtp-105 -74.71 -38.03 62.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.222 -0.445 . . . . 75.44 110.813 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.404 ' CG ' ' N ' ' A' ' 84' ' ' ARG . 1.0 OUTLIER -58.29 -42.37 86.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.254 -0.43 . . . . 74.55 110.921 -179.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.404 ' N ' ' CG ' ' A' ' 83' ' ' GLN . 1.1 ptm180 -67.54 -16.45 64.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 73.14 110.906 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -98.01 -72.26 0.66 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 65.4 110.861 -179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -88.13 130.04 35.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.101 -0.499 . . . . 74.3 110.876 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 25.1 tp . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.16 -0.473 . . . . 72.04 110.944 179.973 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.248 0 N-CA-C 112.465 -0.254 . . . . 74.44 112.465 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -153.86 149.1 27.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.861 0.363 . . . . 75.1 110.84 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.5 p -126.97 142.89 51.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.138 -0.483 . . . . 52.22 110.871 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -142.82 -156.98 6.97 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.676 -0.773 . . . . 44.42 112.418 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.1 m -113.79 27.1 9.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.871 0.367 . . . . 62.01 110.846 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.7 t -105.74 142.53 35.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 54.51 110.843 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 8' ' ' LEU . . . 52.23 -177.72 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.65 -0.786 . . . . 64.33 112.5 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.955 HD13 ' HG3' ' A' ' 62' ' ' ARG . 0.7 OUTLIER -34.28 143.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.821 0.343 . . . . 74.32 110.922 179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.67 ' O ' HD12 ' A' ' 8' ' ' LEU . 69.6 mtt180 -79.45 144.02 60.78 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.614 0.721 . . . . 74.54 110.849 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -167.89 0.25 Allowed 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.636 2.224 . . . . 75.14 112.317 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.62 HD21 HD11 ' A' ' 23' ' ' LEU . 14.0 tp -142.91 145.16 32.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 40.11 110.95 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.593 ' OE2' HG11 ' A' ' 24' ' ' VAL . 31.8 tt0 -90.5 139.94 30.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 61.22 110.883 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.482 ' CZ ' ' HB3' ' A' ' 11' ' ' LEU . 68.7 m-85 -138.88 169.53 17.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.13 -0.487 . . . . 71.42 110.817 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.851 HD21 ' HG3' ' A' ' 82' ' ' ARG . 14.8 mt -142.3 162.01 36.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 71.13 110.873 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 45.4 mtp180 -128.0 149.8 50.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 73.44 110.911 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.2 p -107.04 168.13 9.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 74.24 111.135 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 30.8 t -82.82 -31.46 28.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 64.44 110.831 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.71 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -101.84 70.87 1.26 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.147 -0.479 . . . . 54.04 110.929 -179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.413 ' C ' ' O ' ' A' ' 18' ' ' LEU . . . 37.1 91.63 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.765 -0.731 . . . . 61.31 112.504 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -173.81 153.85 18.28 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.725 -0.75 . . . . 62.12 112.504 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.7 ttm180 -131.74 137.89 48.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.897 0.38 . . . . 70.55 110.849 -179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -116.88 157.8 25.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.208 -0.451 . . . . 75.12 110.841 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.62 HD11 HD21 ' A' ' 11' ' ' LEU . 13.6 tp -120.84 117.08 26.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 75.24 110.853 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.593 HG11 ' OE2' ' A' ' 12' ' ' GLU . 93.7 t -92.31 117.33 35.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 61.21 111.132 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.687 ' CG ' HD13 ' A' ' 63' ' ' ILE . 5.7 t60 -153.52 127.76 9.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.462 . . . . 74.55 110.828 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 61.23 41.63 13.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 74.2 110.884 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.4 m 54.84 35.56 24.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 60.31 110.848 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.412 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 19.1 m-85 -133.03 -176.76 4.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.484 . . . . 62.41 110.91 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.619 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 56.5 mt -133.66 132.66 40.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 63.13 110.951 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.517 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.0 OUTLIER -128.43 169.06 14.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 74.45 110.921 -179.925 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.46 ' CZ ' ' HB3' ' A' ' 31' ' ' ARG . 2.1 mtp-105 -129.69 142.99 50.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 73.35 110.889 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 68.4 tttt -64.13 109.02 1.7 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 75.11 110.903 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -83.06 -55.08 4.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 60.13 110.853 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.0 pttt -153.36 -176.13 5.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.197 -0.456 . . . . 62.03 110.927 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.75 128.05 22.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.249 -0.432 . . . . 74.1 111.129 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' A' ' 38' ' ' GLU . . . -114.07 -177.12 3.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 63.34 111.053 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -42.7 95.31 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.678 -0.772 . . . . 35.15 112.449 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 36' ' ' ALA . 7.0 mp0 55.6 42.65 29.34 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.94 0.4 . . . . 74.1 110.873 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.527 ' HD2' HG21 ' A' ' 57' ' ' ILE . 39.6 mtmt -150.12 160.68 43.48 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.218 -0.446 . . . . 62.42 110.833 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.5 t -138.94 121.0 17.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 62.14 111.133 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -85.3 139.42 31.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.192 -0.458 . . . . 75.1 110.903 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.545 ' CG ' HD22 ' A' ' 23' ' ' LEU . 74.1 m95 -129.55 157.04 43.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.131 -0.486 . . . . 74.33 110.924 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 20.3 ptt? -144.07 136.25 26.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.253 -0.431 . . . . 72.41 110.819 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.4 t -46.39 114.95 0.9 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 61.42 110.832 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.619 ' CZ ' HD13 ' A' ' 29' ' ' LEU . 19.0 ptt180 -55.18 -21.43 13.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.118 -0.492 . . . . 72.51 110.883 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.33 36.6 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.145 -0.479 . . . . 74.02 110.892 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -80.54 -36.45 33.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 71.14 110.927 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.43 -15.33 25.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.185 -0.461 . . . . 64.4 111.046 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 10.5 ttm180 -98.79 -62.12 1.28 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.215 -0.448 . . . . 73.01 110.806 -179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.437 HD13 ' CG ' ' A' ' 71' ' ' HIS . 95.4 mt -97.28 26.84 4.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 72.3 110.939 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.02 47.72 1.03 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.753 -0.736 . . . . 70.23 112.538 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 7.6 t -95.65 148.96 21.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.771 0.32 . . . . 74.12 110.895 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 27.7 mmm180 -124.83 8.25 8.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 75.44 110.937 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.462 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 22.8 t -58.36 147.13 32.21 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.166 -0.47 . . . . 50.41 110.845 -179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 46.9 mtt180 -146.98 164.2 33.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 72.13 110.862 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.675 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -152.43 153.81 34.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 73.02 111.149 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.527 HG21 ' HD2' ' A' ' 39' ' ' LYS . 85.8 mt -119.25 126.22 75.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.23 -0.441 . . . . 62.33 111.058 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.544 HG22 HG13 ' A' ' 63' ' ' ILE . 49.7 p -103.05 144.69 30.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 72.1 111.144 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -133.81 87.11 2.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.225 -0.443 . . . . 73.35 110.925 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.9 -86.62 1.55 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 63.24 112.472 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.922 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -128.11 -5.59 5.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.75 0.31 . . . . 72.12 110.832 -179.911 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.955 ' HG3' HD13 ' A' ' 8' ' ' LEU . 11.1 mtm105 -96.4 -178.32 4.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 73.21 110.885 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.687 HD13 ' CG ' ' A' ' 25' ' ' HIS . 8.5 tt -150.63 156.44 6.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 74.43 111.156 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.675 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 1.6 ttp -143.26 144.78 32.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 72.5 110.892 179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 86.3 t -102.08 148.64 7.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.227 -0.442 . . . . 74.03 111.14 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 19.1 mtm -119.23 -62.15 1.55 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 71.11 110.899 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.9 mtt85 -103.11 164.31 11.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 72.3 110.921 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.2 m -90.86 175.34 7.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.223 -0.444 . . . . 75.25 110.903 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.462 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 65.1 m-70 -112.88 134.6 54.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.179 -0.464 . . . . 73.11 110.895 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.6 m -92.0 13.42 18.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.465 . . . . 53.21 110.956 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.437 ' CG ' HD13 ' A' ' 50' ' ' LEU . 31.0 p80 -139.67 166.3 24.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.133 -0.485 . . . . 75.13 110.876 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -95.66 153.72 39.34 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.635 0.731 . . . . 71.44 110.963 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.412 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.74 152.7 69.48 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.73 2.286 . . . . 71.25 112.312 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -114.37 75.67 0.94 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 74.45 110.912 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.6 mt -49.56 -19.76 0.64 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.242 -0.435 . . . . 71.31 110.927 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.02 -50.01 6.26 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.175 -0.466 . . . . 50.14 111.073 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.76 -34.01 88.78 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.744 -0.741 . . . . 64.43 112.472 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.3 tp -73.65 -44.49 56.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.823 0.344 . . . . 74.41 111.0 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -63.64 -26.76 68.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.154 -0.476 . . . . 71.53 110.875 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.82 -55.57 14.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.201 -0.454 . . . . 72.5 111.129 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.5 mt -46.51 -49.32 18.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.169 -0.469 . . . . 54.33 110.946 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.851 ' HG3' HD21 ' A' ' 14' ' ' LEU . 9.1 mtt-85 -58.23 -35.44 71.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.444 . . . . 74.32 110.881 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.431 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 1.7 tp60 -75.72 -21.97 57.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.216 -0.447 . . . . 73.45 110.938 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 58.1 mtp85 -86.78 -20.3 27.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 74.55 110.91 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.837 ' OE2' HD22 ' A' ' 14' ' ' LEU . 33.3 mt-10 -82.51 -72.77 0.43 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 63.12 110.915 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.438 ' CZ ' ' CB ' ' A' ' 86' ' ' ARG . 3.9 mtp-105 -88.7 165.07 14.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 74.44 110.893 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.3 tp . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 116.167 -0.469 . . . . 71.21 110.904 -179.968 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.49 -0.244 . . . . 72.32 112.49 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.7 t -116.15 147.19 41.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.855 0.359 . . . . 62.5 110.84 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 89.9 p -118.09 165.18 14.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 72.01 110.869 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.77 -167.5 1.1 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.651 -0.785 . . . . 72.55 112.558 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.5 p -127.77 -61.31 1.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.833 0.349 . . . . 73.24 110.793 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m -94.02 80.92 4.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.233 -0.439 . . . . 52.4 110.828 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -145.88 158.77 27.78 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.747 -0.74 . . . . 72.32 112.444 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.841 HD12 ' HD3' ' A' ' 62' ' ' ARG . 3.5 tp -112.23 97.2 6.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.824 0.345 . . . . 64.32 110.899 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 45.6 mtp180 -91.46 145.18 30.84 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.553 0.692 . . . . 70.0 110.893 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.492 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 52.9 Cg_endo -69.8 -178.45 2.36 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.735 2.29 . . . . 72.22 112.354 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.807 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 18.0 tp -140.9 153.64 45.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 71.25 110.875 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 60.3 tt0 -110.89 140.44 45.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.158 -0.474 . . . . 72.35 110.899 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.807 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 8.6 m-85 -137.33 172.96 12.21 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.474 . . . . 72.31 110.89 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.907 HD21 ' HG3' ' A' ' 82' ' ' ARG . 3.7 mt -148.04 160.23 43.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.19 -0.459 . . . . 75.15 110.906 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 -116.84 148.59 41.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 65.21 110.848 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.9 p -115.28 134.7 54.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.182 -0.463 . . . . 75.51 111.155 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.0 t -64.96 -43.56 92.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.223 -0.444 . . . . 65.32 110.832 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.0 mt -50.14 -19.07 0.67 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.171 -0.468 . . . . 43.03 110.89 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 109.55 73.82 0.78 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.716 -0.754 . . . . 63.1 112.541 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -177.11 -179.67 47.57 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.784 -0.722 . . . . 53.2 112.502 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.6 tpp180 -131.87 148.04 52.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.784 0.326 . . . . 62.23 110.892 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -123.95 160.89 26.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.22 -0.445 . . . . 74.21 110.928 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.796 HD11 HD21 ' A' ' 11' ' ' LEU . 10.9 tp -122.56 118.69 28.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.205 -0.452 . . . . 72.14 110.918 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.684 ' CG2' HD12 ' A' ' 14' ' ' LEU . 24.2 t -94.79 108.22 20.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 63.45 111.166 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.832 ' CG ' HD13 ' A' ' 63' ' ' ILE . 50.1 t60 -145.12 134.14 22.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.243 -0.435 . . . . 73.3 110.86 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 59.54 33.18 22.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.205 -0.452 . . . . 71.14 110.94 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 14.1 m 65.3 25.39 12.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.069 -0.514 . . . . 75.34 110.854 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.497 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 15.4 m-85 -127.84 179.18 5.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.117 -0.492 . . . . 72.24 110.875 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.485 HD11 HD12 ' A' ' 81' ' ' LEU . 11.2 mt -128.37 133.14 48.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.144 -0.48 . . . . 64.51 110.931 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.505 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.1 m-85 -124.57 164.19 20.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.244 -0.435 . . . . 75.04 110.906 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 20.2 mtp180 -123.23 134.34 54.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 74.13 110.85 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 34.4 tttm -59.93 110.02 1.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 72.44 110.84 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -85.0 -54.08 4.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.157 -0.474 . . . . 73.32 110.916 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.415 ' CG ' ' HB2' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -146.55 171.26 15.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 72.5 110.881 179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -133.39 115.01 14.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 64.03 111.125 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.408 ' O ' ' C ' ' A' ' 37' ' ' GLY . . . -89.14 -175.62 4.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 51.04 111.159 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.408 ' C ' ' O ' ' A' ' 36' ' ' ALA . . . -37.59 -72.48 0.17 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.761 -0.733 . . . . 24.15 112.444 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.8 mp0 -125.76 39.78 3.88 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.945 0.402 . . . . 75.44 110.933 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.66 ' HE3' HG21 ' A' ' 57' ' ' ILE . 40.9 mtpt -145.21 167.9 21.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.149 -0.478 . . . . 71.04 110.89 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 t -138.38 126.15 28.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.208 -0.451 . . . . 71.11 111.08 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.415 ' HB2' ' CG ' ' A' ' 34' ' ' LYS . 2.7 m-85 -90.49 139.56 30.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.132 -0.486 . . . . 71.32 110.967 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 68.9 m95 -132.99 167.59 20.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 74.33 110.894 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 24.4 ptt? -152.47 130.72 12.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 72.31 110.912 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.404 ' C ' ' N ' ' A' ' 46' ' ' ASP . 2.0 t -44.35 106.48 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 74.43 110.869 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 34.5 ptt85 -44.05 -23.26 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 73.54 110.839 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.404 ' N ' ' C ' ' A' ' 44' ' ' CYS . 2.0 m-20 -85.31 31.31 0.58 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 74.13 110.834 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.406 ' CD ' ' C ' ' A' ' 47' ' ' GLN . 3.9 tm0? -82.85 -23.63 33.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 73.25 110.921 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.62 -25.84 14.98 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.177 -0.465 . . . . 55.22 111.081 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.36 -52.8 3.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 73.54 110.806 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.438 HD13 ' CG ' ' A' ' 71' ' ' HIS . 54.3 mt -94.39 9.43 38.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 74.4 110.91 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 46.88 32.65 6.17 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.688 -0.768 . . . . 50.3 112.537 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 36.4 t -80.7 122.23 26.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.8 0.333 . . . . 62.42 110.88 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 26.1 mmm180 -101.5 37.21 1.85 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 74.33 110.869 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.1 t -88.77 119.65 29.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 73.54 110.862 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -117.02 146.92 42.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 72.13 110.88 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.639 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -139.4 164.85 28.76 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 54.23 111.029 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.66 HG21 ' HE3' ' A' ' 39' ' ' LYS . 61.4 mt -132.0 117.39 33.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.245 -0.434 . . . . 75.53 111.174 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.583 HG22 HG13 ' A' ' 63' ' ' ILE . 23.7 p -102.73 144.55 30.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 73.0 111.168 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.72 109.12 3.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.221 -0.445 . . . . 71.2 110.901 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.23 -102.86 2.65 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.818 -0.706 . . . . 64.41 112.505 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.492 ' CD2' ' HA ' ' A' ' 10' ' ' PRO . 1.8 t60 -127.51 4.78 6.21 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.723 0.297 . . . . 73.22 110.786 -179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.841 ' HD3' HD12 ' A' ' 8' ' ' LEU . 19.4 mtm180 -110.68 -175.57 2.75 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 74.11 110.8 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.832 HD13 ' CG ' ' A' ' 25' ' ' HIS . 18.7 tt -150.21 157.27 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 73.53 111.11 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.639 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 3.2 ttp -134.83 141.57 46.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.24 -0.436 . . . . 65.33 110.838 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 19.3 t -111.91 138.44 40.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.454 . . . . 64.25 111.163 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 3.1 mtt -105.65 -56.84 2.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.194 -0.457 . . . . 73.33 110.887 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.459 ' HD3' ' N ' ' A' ' 68' ' ' SER . 0.0 OUTLIER -118.74 144.48 46.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 71.24 110.835 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.459 ' N ' ' HD3' ' A' ' 67' ' ' ARG . 14.2 t -69.25 -179.6 1.65 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.479 . . . . 74.3 110.898 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.447 ' N ' ' OG ' ' A' ' 68' ' ' SER . 20.5 m-70 -109.27 145.76 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 74.32 110.852 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.7 t -93.4 6.19 49.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 71.02 110.848 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.438 ' CG ' HD13 ' A' ' 50' ' ' LEU . 26.2 p80 -137.32 165.63 25.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 52.53 110.911 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -100.42 150.31 36.84 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.61 0.719 . . . . 75.24 110.913 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.497 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.5 Cg_endo -69.74 158.86 55.53 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.664 2.243 . . . . 63.31 112.292 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -139.81 90.54 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.472 . . . . 63.14 110.871 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.8 mt -55.82 -14.23 2.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.232 -0.44 . . . . 70.43 110.909 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.4 -49.06 58.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 72.21 111.07 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.99 -32.94 34.57 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.746 -0.74 . . . . 65.2 112.487 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.427 HD11 ' HE ' ' A' ' 82' ' ' ARG . 7.3 tp -67.79 -39.93 83.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 62.22 110.925 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -63.4 -24.8 68.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.134 -0.484 . . . . 73.4 110.91 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.22 70.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 74.24 111.097 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.485 HD12 HD11 ' A' ' 29' ' ' LEU . 50.3 mt -63.85 -51.67 63.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 73.23 110.909 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.907 ' HG3' HD21 ' A' ' 14' ' ' LEU . 0.1 OUTLIER -55.72 -21.59 19.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 74.41 110.953 179.868 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.415 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 0.6 OUTLIER -78.67 -21.93 47.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.152 -0.476 . . . . 71.3 110.926 -179.914 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -81.49 -56.75 3.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.171 -0.468 . . . . 75.44 110.891 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.68 ' OE1' HD23 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -43.55 -34.15 1.32 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 64.13 110.837 -179.964 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -100.47 145.03 28.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.189 -0.46 . . . . 74.31 110.823 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.7 mt . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 73.33 110.941 179.996 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 112.536 -0.226 . . . . 73.4 112.536 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.2 m -118.33 -54.83 2.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.845 0.355 . . . . 61.23 110.846 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 23.3 t -45.02 138.2 3.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 73.5 110.905 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.07 -170.48 46.15 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.786 -0.721 . . . . 54.41 112.456 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.7 p -100.34 109.42 21.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.904 0.383 . . . . 75.52 110.877 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.465 ' O ' ' N ' ' A' ' 8' ' ' LEU . 56.6 m -81.85 -47.19 13.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 63.34 110.817 -179.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 61.43 -75.69 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.748 -0.739 . . . . 43.21 112.481 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.465 ' N ' ' O ' ' A' ' 6' ' ' SER . 1.2 pt? -129.85 147.01 51.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.753 0.311 . . . . 72.44 110.933 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.6 mmt180 -87.94 144.25 34.47 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.61 0.719 . . . . 62.11 110.841 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.496 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 53.5 Cg_endo -69.78 -164.93 0.14 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.66 2.24 . . . . 75.12 112.381 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.597 HD22 ' HB ' ' A' ' 63' ' ' ILE . 13.5 tp -156.11 165.72 35.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.277 -0.419 . . . . 72.44 110.924 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -112.59 140.74 47.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.435 . . . . 75.54 110.971 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.568 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 70.3 m-85 -139.84 172.91 12.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 61.54 110.887 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.672 HD12 ' CG2' ' A' ' 24' ' ' VAL . 6.3 mt -151.78 162.5 40.92 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.132 -0.486 . . . . 75.43 110.841 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -127.95 149.84 50.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 73.43 110.842 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.432 ' O ' ' C ' ' A' ' 17' ' ' SER . 2.9 p -106.87 156.18 18.96 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.209 -0.45 . . . . 64.21 111.155 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.432 ' C ' ' O ' ' A' ' 16' ' ' THR . 5.6 m -35.75 -61.42 0.47 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 62.23 110.876 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.64 ' N ' HD13 ' A' ' 18' ' ' LEU . 0.1 OUTLIER -84.63 -175.06 5.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.077 -0.51 . . . . 71.32 110.889 -179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -58.98 78.84 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.699 -0.762 . . . . 50.44 112.525 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.48 ' N ' ' O ' ' A' ' 18' ' ' LEU . . . -150.3 148.96 20.73 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.74 -0.743 . . . . 74.41 112.449 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.436 ' NE ' ' O ' ' A' ' 14' ' ' LEU . 5.9 tpt180 -140.94 129.12 22.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.85 0.357 . . . . 71.42 110.88 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -105.43 160.53 15.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 72.53 110.925 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.566 HD13 ' CE1' ' A' ' 13' ' ' PHE . 20.3 tp -119.66 125.27 48.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 71.51 110.936 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.672 ' CG2' HD12 ' A' ' 14' ' ' LEU . 20.9 t -106.15 123.0 60.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 65.23 111.162 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.788 ' CG ' HD13 ' A' ' 63' ' ' ILE . 64.9 t60 -153.02 138.77 17.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.138 -0.483 . . . . 75.33 110.877 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 54.82 24.68 5.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.234 -0.439 . . . . 74.34 110.878 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m 75.24 26.63 1.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.487 . . . . 44.51 110.903 -179.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -124.94 -176.07 3.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 74.32 110.899 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.645 HD13 ' NE ' ' A' ' 45' ' ' ARG . 56.0 mt -128.98 147.56 50.87 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 65.44 110.888 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.602 ' CD1' ' C ' ' A' ' 29' ' ' LEU . 1.0 OUTLIER -144.77 173.75 11.57 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.205 -0.452 . . . . 65.21 110.915 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -135.59 141.91 45.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.126 -0.488 . . . . 72.31 110.887 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 29.2 tttm -64.35 115.51 5.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.206 -0.452 . . . . 73.24 110.882 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -92.91 -57.18 2.73 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.25 -0.432 . . . . 71.34 110.926 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -150.6 179.04 8.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.13 -0.487 . . . . 53.11 110.951 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -136.88 117.73 14.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.216 -0.447 . . . . 54.02 111.177 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.57 -175.57 3.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 62.04 111.04 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -48.97 94.36 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.72 -0.752 . . . . 71.24 112.494 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 62.51 34.59 15.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.934 0.397 . . . . 73.23 110.887 -179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -145.33 158.03 43.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 74.13 110.885 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.1 t -138.25 114.17 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 62.41 111.114 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -78.69 146.07 34.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 74.32 110.914 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.545 ' CD2' HD22 ' A' ' 23' ' ' LEU . 69.5 m95 -135.88 151.85 50.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.079 -0.509 . . . . 62.31 110.905 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.9 ptt? -134.93 129.82 34.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.182 -0.463 . . . . 65.23 110.895 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.6 t -42.81 116.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 74.45 110.859 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.645 ' NE ' HD13 ' A' ' 29' ' ' LEU . 18.3 ptt180 -55.14 -20.55 10.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 60.32 110.874 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.54 36.44 0.54 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.464 . . . . 65.0 110.854 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -88.43 -18.88 27.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.143 -0.48 . . . . 74.52 110.913 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.12 -31.05 12.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.259 -0.428 . . . . 64.01 111.144 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.0 ttm-85 -95.05 -57.36 2.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 71.23 110.811 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.475 ' O ' ' N ' ' A' ' 52' ' ' CYS . 22.6 mt -95.61 22.65 6.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 63.2 110.915 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.416 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.94 29.66 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.687 -0.768 . . . . 73.23 112.466 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.475 ' N ' ' O ' ' A' ' 50' ' ' LEU . 4.7 t -75.76 127.66 33.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.844 0.354 . . . . 74.21 110.852 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.33 -10.92 17.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.139 -0.482 . . . . 74.32 110.844 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.7 m -39.32 128.26 1.8 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.229 -0.441 . . . . 51.32 110.86 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.401 ' C ' ' HG3' ' A' ' 66' ' ' MET . 16.0 mtt85 -123.82 166.03 16.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 74.42 110.842 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.476 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -149.72 156.51 41.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 75.05 111.075 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 91.0 mt -125.42 122.49 62.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.206 -0.452 . . . . 71.11 111.121 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.675 HG22 HG13 ' A' ' 63' ' ' ILE . 34.3 p -101.1 142.43 32.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.47 . . . . 74.32 111.128 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.95 87.17 2.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 73.13 110.95 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.45 -85.23 1.56 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.721 -0.752 . . . . 71.13 112.486 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.496 ' CG ' ' HA ' ' A' ' 10' ' ' PRO . 0.4 OUTLIER -128.89 -1.24 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.771 0.32 . . . . 63.31 110.855 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.444 ' CZ ' ' HB3' ' A' ' 62' ' ' ARG . 1.4 mtp-105 -102.71 174.39 5.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 62.32 110.888 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.788 HD13 ' CG ' ' A' ' 25' ' ' HIS . 4.9 tt -145.06 154.14 14.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 72.01 111.114 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.476 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 9.4 ttp -138.16 142.66 40.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.149 -0.478 . . . . 75.42 110.882 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.1 t -95.14 145.03 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 74.33 111.067 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.401 ' HG3' ' C ' ' A' ' 55' ' ' ARG . 31.0 mtp -104.77 -61.04 1.51 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.088 -0.505 . . . . 74.31 110.783 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -123.02 162.65 21.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.27 -0.423 . . . . 70.23 110.888 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.34 153.91 29.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 43.4 110.86 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -92.37 137.86 32.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.099 -0.5 . . . . 75.04 110.848 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 51.9 t -89.48 10.1 24.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.128 -0.487 . . . . 72.25 110.865 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.44 ' CB ' HD13 ' A' ' 50' ' ' LEU . 31.8 p80 -136.93 142.81 42.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 73.5 110.801 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -79.8 155.59 75.49 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.587 0.708 . . . . 74.23 110.914 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.66 155.86 65.14 Favored 'Trans proline' 0 N--CA 1.465 -0.187 0 C-N-CA 122.743 2.295 . . . . 70.11 112.365 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -133.14 80.37 1.88 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.241 -0.436 . . . . 70.41 110.884 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.514 HD23 ' N ' ' A' ' 75' ' ' LEU . 3.4 mt -45.78 -23.85 0.31 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.234 -0.439 . . . . 74.12 110.848 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.57 -43.18 73.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 54.31 111.088 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -77.99 -36.8 30.94 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.753 -0.737 . . . . 70.03 112.465 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tp -69.64 -37.39 76.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.741 0.305 . . . . 75.21 110.94 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -68.98 -29.44 67.64 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 74.14 110.904 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.63 93.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.1 -0.5 . . . . 64.12 111.102 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 61.4 mt -67.98 -46.96 69.88 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.23 -0.441 . . . . 65.15 110.966 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.8 mtp-105 -65.95 -20.73 66.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.791 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.44 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -75.08 -29.27 60.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.26 -0.427 . . . . 74.43 110.963 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 23.4 mtp85 -77.98 -28.23 49.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 73.13 110.874 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -62.63 -59.09 5.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 75.14 110.861 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 -108.15 90.45 3.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 62.11 110.828 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.54 ' C ' HD12 ' A' ' 87' ' ' LEU . 4.4 pp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.172 -0.467 . . . . 74.24 110.843 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.463 ' O ' ' N ' ' A' ' 3' ' ' SER . . . . . . . . 0 N--CA 1.452 -0.288 0 N-CA-C 112.47 -0.252 . . . . 74.41 112.47 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 1' ' ' GLY . 1.4 m 34.52 34.28 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.877 0.37 . . . . 73.31 110.884 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.463 ' N ' ' O ' ' A' ' 1' ' ' GLY . 1.9 m -61.94 -24.99 67.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.088 -0.506 . . . . 72.33 110.797 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.49 -157.63 33.87 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.766 -0.731 . . . . 54.3 112.504 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 28.5 t -155.38 127.76 7.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.822 0.344 . . . . 51.02 110.84 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 13.6 t -112.41 4.12 17.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 75.33 110.877 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 131.43 1.78 4.67 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.81 -0.71 . . . . 61.21 112.495 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.813 ' C ' HD12 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -106.54 96.24 6.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.817 0.342 . . . . 64.21 110.88 -179.888 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.479 ' N ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -77.78 143.92 67.87 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.571 0.7 . . . . 71.14 110.924 179.911 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.487 ' CB ' ' CE1' ' A' ' 61' ' ' HIS . 53.5 Cg_endo -69.76 -176.36 1.46 Allowed 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 122.649 2.232 . . . . 72.45 112.401 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.615 HD21 HD11 ' A' ' 23' ' ' LEU . 28.8 tp -135.93 143.28 44.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.299 -0.409 . . . . 73.23 110.951 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.464 ' OE1' HG11 ' A' ' 24' ' ' VAL . 41.3 tt0 -98.15 147.47 24.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.463 . . . . 73.2 110.858 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.537 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 52.3 m-85 -136.68 172.86 12.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 63.05 110.874 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.507 HD12 ' CG2' ' A' ' 24' ' ' VAL . 5.0 mt -147.51 158.29 43.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 72.45 110.923 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.0 mtt180 -124.46 128.01 48.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 73.12 110.876 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.435 HG21 ' CE1' ' A' ' 22' ' ' PHE . 11.2 p -94.46 143.7 26.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.11 -0.496 . . . . 73.54 111.209 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 58.1 m -58.31 -21.16 48.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.248 -0.433 . . . . 60.32 110.956 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 mp -80.65 42.5 0.62 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.05 -0.523 . . . . 53.44 110.919 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 48.3 19.38 1.13 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.785 -0.722 . . . . 33.23 112.483 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -106.75 166.01 13.52 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.766 -0.73 . . . . 72.51 112.448 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.6 ttt85 -123.9 124.27 42.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.851 0.358 . . . . 74.44 110.915 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.556 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -100.99 170.73 8.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.441 . . . . 73.0 110.855 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.615 HD11 HD21 ' A' ' 11' ' ' LEU . 4.3 tp -139.1 138.17 36.83 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 72.31 110.93 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.507 ' CG2' HD12 ' A' ' 14' ' ' LEU . 18.1 t -104.26 126.55 58.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.451 . . . . 71.42 111.093 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.771 ' CG ' HD13 ' A' ' 63' ' ' ILE . 5.2 t60 -159.73 132.28 6.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.128 -0.487 . . . . 72.23 110.844 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 53.17 37.79 25.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.224 -0.444 . . . . 64.41 110.9 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 72.1 m 63.05 26.7 15.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.128 -0.487 . . . . 65.01 110.857 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -126.68 164.11 22.0 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 73.53 110.807 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.552 HD12 ' CZ ' ' A' ' 45' ' ' ARG . 62.6 mt -115.3 137.64 51.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 72.22 110.867 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.536 ' CE1' ' HB3' ' A' ' 25' ' ' HIS . 1.6 m-85 -127.16 168.02 15.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 71.41 110.995 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.556 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 12.4 mtp-105 -128.72 118.38 22.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 72.04 110.893 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.446 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 32.8 tttm -41.57 116.6 0.79 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.224 -0.444 . . . . 70.24 110.836 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -91.5 -54.34 3.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.219 -0.446 . . . . 73.11 110.906 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.91 -178.19 6.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 74.24 110.894 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -147.89 135.19 20.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.171 -0.468 . . . . 60.12 111.13 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -104.81 36.49 2.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 53.32 111.076 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.25 -63.27 4.45 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.722 -0.751 . . . . 74.24 112.43 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -101.75 -26.87 13.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.964 0.411 . . . . 63.2 110.866 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.9 mtmp? -105.4 159.91 15.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.483 . . . . 75.31 110.86 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.4 t -137.57 116.75 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.214 -0.448 . . . . 74.44 111.179 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.557 ' CE2' HD11 ' A' ' 57' ' ' ILE . 3.4 m-85 -80.75 145.9 31.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 63.04 110.954 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.542 ' CD1' HG23 ' A' ' 58' ' ' THR . 77.1 m95 -137.29 148.7 46.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 71.03 110.874 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 12.2 ptt? -131.62 126.88 35.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 63.53 110.843 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -42.54 120.78 1.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.442 . . . . 74.31 110.85 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.552 ' CZ ' HD12 ' A' ' 29' ' ' LEU . 19.8 ptt180 -53.02 -17.84 1.7 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 63.25 110.884 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.564 ' HB3' HD12 ' A' ' 50' ' ' LEU . 1.1 m-20 -87.88 17.45 4.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.223 -0.444 . . . . 73.44 110.903 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.41 ' C ' ' CD ' ' A' ' 47' ' ' GLN . 0.0 OUTLIER -78.49 -15.5 58.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.227 -0.442 . . . . 61.22 110.888 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.403 ' HB2' ' OE1' ' A' ' 47' ' ' GLN . . . -96.76 -32.85 11.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.294 -0.412 . . . . 63.44 111.05 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.2 tpp180 -98.38 -62.51 1.23 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.232 -0.44 . . . . 74.01 110.843 -179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.564 HD12 ' HB3' ' A' ' 46' ' ' ASP . 31.6 mt -83.12 15.45 2.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 52.11 110.922 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.61 33.54 1.55 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.789 -0.72 . . . . 71.51 112.429 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.405 ' N ' ' HA ' ' A' ' 47' ' ' GLN . 38.1 t -77.75 108.91 11.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.8 0.333 . . . . 75.14 110.92 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -84.35 12.56 6.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 74.31 110.856 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.1 t -60.22 113.41 2.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 75.45 110.874 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 34.6 mtm180 -119.34 137.94 53.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 75.54 110.867 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.64 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -126.6 160.43 30.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 74.42 111.132 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.557 HD11 ' CE2' ' A' ' 41' ' ' TYR . 31.6 mt -128.23 128.36 68.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 74.1 111.158 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.542 HG23 ' CD1' ' A' ' 42' ' ' TRP . 19.3 p -101.95 147.39 26.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 74.12 111.205 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -142.83 106.89 4.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 72.43 110.875 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 69.93 -92.86 0.39 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.744 -0.741 . . . . 75.01 112.51 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.487 ' CE1' ' CB ' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -128.82 6.91 5.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.772 0.32 . . . . 75.1 110.887 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.672 ' CG ' HD13 ' A' ' 8' ' ' LEU . 39.4 mtp85 -108.03 -175.93 2.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.287 -0.415 . . . . 74.12 110.867 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.771 HD13 ' CG ' ' A' ' 25' ' ' HIS . 9.8 tt -150.35 153.41 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 74.31 111.104 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.64 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 68.2 mtm -135.92 146.88 47.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 71.4 110.832 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.2 t -116.51 132.23 66.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 70.44 111.13 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mmm -92.02 -58.55 2.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 55.1 110.891 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 17.6 ttm180 -118.44 160.19 22.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 74.04 110.861 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.2 m -78.62 -179.71 6.61 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.178 -0.465 . . . . 61.1 110.76 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -108.26 139.83 42.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.105 -0.498 . . . . 60.42 110.814 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 13.1 t -94.52 15.91 16.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 54.14 110.922 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.458 ' CB ' HD13 ' A' ' 50' ' ' LEU . 24.3 p80 -145.25 150.89 37.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.144 -0.48 . . . . 71.53 110.826 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -81.07 152.43 71.32 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.579 0.704 . . . . 62.21 110.964 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 149.61 67.36 Favored 'Trans proline' 0 C--N 1.342 0.229 0 C-N-CA 122.708 2.272 . . . . 73.11 112.372 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -123.33 81.42 1.89 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.271 -0.422 . . . . 51.21 110.837 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 34.7 mt -53.95 -23.48 13.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 73.52 110.971 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.0 -45.71 66.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 55.02 111.147 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.01 -31.38 43.41 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.728 -0.749 . . . . 53.21 112.519 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tp -70.68 -38.3 73.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.723 0.297 . . . . 71.55 110.911 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -68.55 -23.46 64.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.254 -0.43 . . . . 74.44 110.849 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.55 -44.57 86.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 41.4 111.077 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.2 mt -69.92 -50.35 42.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.25 -0.432 . . . . 75.21 110.885 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.433 ' HG3' HD11 ' A' ' 14' ' ' LEU . 50.3 mtp180 -60.25 -19.61 55.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.215 -0.448 . . . . 71.24 110.879 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.411 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 0.5 OUTLIER -76.76 -24.39 52.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 72.21 110.909 -179.905 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 85' ' ' GLU . 29.0 mtt180 -85.81 -35.05 20.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 75.12 110.822 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.405 ' C ' ' O ' ' A' ' 84' ' ' ARG . 1.0 OUTLIER -37.77 -44.42 0.73 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 61.44 110.924 -179.889 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.25 139.9 38.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 71.11 110.871 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.6 tp . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 73.44 110.921 179.966 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.374 0 N-CA-C 112.487 -0.245 . . . . 44.12 112.487 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.4 t -145.6 152.84 40.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.921 0.391 . . . . 74.3 110.876 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.6 t -71.6 98.85 1.96 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.14 -0.482 . . . . 74.43 110.861 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.74 157.18 15.46 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.741 -0.742 . . . . 55.11 112.454 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 41.3 t -104.4 13.41 32.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.88 0.371 . . . . 71.03 110.885 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 28.4 m -85.57 -32.06 22.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 64.4 110.924 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 114.53 -84.96 0.38 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.794 -0.717 . . . . 63.31 112.53 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.975 HD12 ' HG3' ' A' ' 62' ' ' ARG . 0.5 OUTLIER -172.19 176.73 3.35 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.812 0.339 . . . . 70.54 110.921 -179.912 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.8 mtt85 -111.53 144.0 29.66 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.638 0.733 . . . . 64.44 110.894 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.4 ' HB3' ' NE2' ' A' ' 61' ' ' HIS . 53.5 Cg_endo -69.76 177.68 5.33 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.663 2.242 . . . . 72.33 112.304 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.725 HD21 HD11 ' A' ' 23' ' ' LEU . 24.5 tp -145.45 145.02 30.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 70.31 110.968 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 -101.24 152.87 20.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.212 -0.449 . . . . 61.11 110.942 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.696 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 61.6 m-85 -137.93 169.93 16.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.832 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.623 HD12 ' CG2' ' A' ' 24' ' ' VAL . 4.1 mt -145.08 165.21 28.89 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.148 -0.478 . . . . 53.34 110.956 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.7 ptp180 -127.8 147.85 50.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.231 -0.44 . . . . 71.33 110.899 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.443 ' OG1' ' N ' ' A' ' 20' ' ' GLY . 1.2 p -115.08 169.91 8.75 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.118 -0.492 . . . . 65.1 111.089 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 67.0 m -95.64 -51.26 4.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.179 -0.464 . . . . 73.32 110.846 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.3 mp -84.97 -44.75 12.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 62.31 110.911 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -71.5 -105.25 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.79 -0.719 . . . . 73.13 112.46 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.443 ' N ' ' OG1' ' A' ' 16' ' ' THR . . . -165.02 -92.15 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.779 -0.724 . . . . 31.02 112.489 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.5 tpt85 -130.64 129.31 42.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.831 0.348 . . . . 63.44 110.813 -179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.471 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -103.55 165.54 10.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 64.25 110.878 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.725 HD11 HD21 ' A' ' 11' ' ' LEU . 8.4 tp -130.4 135.13 47.7 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.484 . . . . 53.2 110.946 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 1.022 HG11 ' NH2' ' A' ' 82' ' ' ARG . 68.0 t -101.85 116.92 46.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 73.33 111.072 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.643 ' CG ' HD13 ' A' ' 63' ' ' ILE . 10.7 t60 -152.83 127.03 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 70.21 110.874 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 59.89 43.43 14.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 72.2 110.867 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.438 ' OG ' ' CD2' ' A' ' 75' ' ' LEU . 1.4 t 56.89 20.11 5.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.122 -0.49 . . . . 74.02 110.88 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.411 ' CE1' ' HA ' ' A' ' 73' ' ' PRO . 20.1 m-85 -116.52 -177.38 3.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 74.21 110.928 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.45 HD12 ' HE ' ' A' ' 45' ' ' ARG . 65.8 mt -134.14 134.08 41.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.182 -0.463 . . . . 74.31 110.897 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -125.93 172.03 10.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.193 -0.458 . . . . 75.31 110.956 -179.997 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.471 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 59.4 mtp180 -131.7 129.08 40.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 73.54 110.924 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.43 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 51.6 tttm -54.86 122.07 9.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.182 -0.463 . . . . 62.52 110.934 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -94.06 -54.81 3.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.27 -0.423 . . . . 64.35 110.903 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.05 164.57 37.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.101 -0.5 . . . . 75.12 110.846 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.48 131.98 54.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.439 . . . . 72.45 111.096 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -101.97 37.13 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.288 -0.414 . . . . 74.32 111.12 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.98 -73.39 2.31 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.682 -0.771 . . . . 62.01 112.453 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -102.95 -11.28 18.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.381 . . . . 72.43 110.9 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 27.5 mtmm -115.38 156.57 25.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.145 -0.48 . . . . 73.41 110.897 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.0 t -133.79 114.42 19.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 74.44 111.144 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -77.74 149.06 34.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 72.2 110.967 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.481 ' CD1' HG23 ' A' ' 58' ' ' THR . 77.2 m95 -139.84 165.21 27.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 75.52 110.952 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 19.4 ptt? -151.45 133.58 15.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.431 . . . . 72.12 110.845 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.7 t -46.22 118.17 1.82 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 75.15 110.88 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.45 ' HE ' HD12 ' A' ' 29' ' ' LEU . 41.6 ptt85 -52.06 -23.89 5.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.164 -0.471 . . . . 73.31 110.878 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -81.98 12.34 4.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 71.43 110.788 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.415 ' C ' ' CD ' ' A' ' 47' ' ' GLN . 5.3 tm0? -71.46 -17.45 62.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.184 -0.462 . . . . 75.15 110.931 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -95.15 -36.76 11.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 74.24 111.109 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.3 mtt85 -93.54 -62.75 1.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 71.34 110.886 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.417 ' O ' ' C ' ' A' ' 51' ' ' GLY . 39.7 mt -84.25 18.32 2.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.469 . . . . 64.21 110.849 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 36.48 38.63 0.29 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.771 -0.728 . . . . 71.21 112.497 179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 32.7 t -78.2 102.32 7.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.819 0.342 . . . . 72.31 110.865 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -81.91 45.61 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 63.33 110.913 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.8 t -100.04 111.7 23.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 71.04 110.921 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -107.17 161.07 15.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 73.22 110.921 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.641 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -149.86 162.6 39.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.257 -0.428 . . . . 55.24 111.116 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 74.6 mt -134.26 125.34 47.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 74.22 111.151 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.481 HG23 ' CD1' ' A' ' 42' ' ' TRP . 32.2 p -101.58 150.84 22.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.209 -0.451 . . . . 73.21 111.15 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -147.71 112.97 5.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 71.13 110.954 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 65.25 -92.75 0.15 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.796 -0.716 . . . . 71.44 112.558 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.462 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -128.94 2.49 5.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.811 0.338 . . . . 75.2 110.883 -179.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.975 ' HG3' HD12 ' A' ' 8' ' ' LEU . 17.1 mtt85 -102.33 -175.31 2.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 73.42 110.796 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.643 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -151.0 156.35 6.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.142 -0.481 . . . . 72.52 111.118 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.641 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 49.3 mtm -136.49 149.05 47.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.451 . . . . 74.32 110.894 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 90.5 t -121.55 133.89 66.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.217 -0.447 . . . . 63.21 111.121 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.4 mtp -93.56 -63.43 1.2 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.14 -0.482 . . . . 61.33 110.834 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -112.82 167.95 10.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.27 -0.423 . . . . 71.45 110.854 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.5 m -84.99 -177.55 6.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.111 -0.495 . . . . 74.12 110.883 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 88.4 m-70 -110.04 137.87 47.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.48 . . . . 71.1 110.903 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.6 t -91.79 13.96 16.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.179 -0.464 . . . . 71.24 110.872 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 24.0 p80 -143.8 159.33 42.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.171 -0.468 . . . . 73.03 110.825 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.0 mm-40 -90.83 153.87 45.41 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.609 0.719 . . . . 73.43 110.891 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.411 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.3 Cg_endo -69.83 139.46 40.04 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.716 2.277 . . . . 73.42 112.289 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.437 ' O ' ' N ' ' A' ' 77' ' ' GLY . 13.1 t0 -101.27 79.35 1.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 74.05 110.874 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.438 ' CD2' ' OG ' ' A' ' 27' ' ' SER . 7.9 mt -46.88 -24.64 0.62 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 73.11 110.935 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -90.66 -26.29 19.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.469 . . . . 73.34 111.124 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 74' ' ' ASP . . . -84.07 -46.62 5.84 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.738 -0.744 . . . . 74.05 112.496 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.4 tp -67.71 -35.63 79.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 73.33 110.914 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -72.26 -31.44 65.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.161 -0.472 . . . . 62.34 110.952 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.72 -44.88 95.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.114 -0.494 . . . . 55.25 111.123 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 11.6 mt -60.18 -41.38 92.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 70.3 110.978 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 1.022 ' NH2' HG11 ' A' ' 24' ' ' VAL . 10.7 mtt180 -74.07 -15.29 61.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.145 -0.48 . . . . 70.45 110.901 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -80.61 -48.71 12.27 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 71.14 110.944 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' A' ' 85' ' ' GLU . 3.2 ptm180 -69.48 -33.14 72.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.18 -0.464 . . . . 73.53 110.95 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.419 ' C ' ' O ' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -36.65 -50.84 0.84 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 72.04 110.887 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.7 mtp180 -102.68 162.52 12.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.167 -0.47 . . . . 74.24 110.904 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.523 ' H ' HD23 ' A' ' 87' ' ' LEU . 1.7 pt? . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 63.15 110.924 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 112.493 -0.243 . . . . 42.11 112.493 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.7 p -53.09 156.38 2.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.864 0.364 . . . . 52.15 110.789 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 22.3 p -163.42 150.37 12.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.051 -0.522 . . . . 71.45 110.827 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -164.06 99.41 0.17 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.726 -0.75 . . . . 32.55 112.474 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.2 m -108.92 166.79 10.55 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.906 0.384 . . . . 65.11 110.803 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 6.5 t -87.3 7.27 29.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.072 -0.513 . . . . 74.41 110.867 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -126.95 39.5 1.95 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.697 -0.764 . . . . 70.42 112.535 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.664 HD13 ' HD2' ' A' ' 62' ' ' ARG . 0.9 OUTLIER -160.97 108.41 1.51 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.884 0.373 . . . . 74.11 110.911 -179.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.589 ' N ' HD12 ' A' ' 8' ' ' LEU . 7.3 mpt_? -104.77 143.99 27.82 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.627 0.727 . . . . 71.33 110.846 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.475 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 53.7 Cg_endo -69.73 -174.77 0.96 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 60.23 112.298 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.975 HD21 HD11 ' A' ' 23' ' ' LEU . 20.4 tp -140.44 150.85 44.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 71.32 110.944 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -105.31 148.28 27.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 71.54 110.88 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -139.81 172.86 12.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.128 -0.487 . . . . 74.24 110.863 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.765 HD21 ' HG2' ' A' ' 82' ' ' ARG . 6.3 mt -150.65 118.51 6.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.138 -0.483 . . . . 64.14 110.926 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.5 mtp180 -98.72 138.24 36.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 74.04 110.832 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.455 HG23 ' O ' ' A' ' 20' ' ' GLY . 1.2 p -114.76 164.3 14.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.462 . . . . 75.44 111.129 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 15.7 m -106.85 -24.1 12.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 62.13 110.88 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.5 mp -98.71 5.85 47.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.109 -0.496 . . . . 64.15 110.92 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -150.16 -109.37 0.47 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.8 -0.714 . . . . 75.23 112.524 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.455 ' O ' HG23 ' A' ' 16' ' ' THR . . . -149.49 -152.79 5.84 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.74 -0.743 . . . . 74.14 112.453 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.46 ' HD3' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -88.25 148.88 24.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.895 0.379 . . . . 74.41 110.825 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.46 ' N ' ' HD3' ' A' ' 21' ' ' ARG . 2.6 m-85 -126.32 157.48 38.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 73.54 110.9 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.975 HD11 HD21 ' A' ' 11' ' ' LEU . 15.7 tp -120.58 116.47 25.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.152 -0.476 . . . . 71.05 110.979 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.585 ' CG2' HD12 ' A' ' 14' ' ' LEU . 58.8 t -90.88 114.52 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.188 -0.46 . . . . 62.32 111.074 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.8 ' CG ' HD13 ' A' ' 63' ' ' ILE . 6.9 t60 -151.6 127.13 10.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.138 -0.483 . . . . 63.23 110.868 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 62.97 38.51 11.05 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.214 -0.448 . . . . 72.12 110.897 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 m 60.03 29.19 18.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.091 -0.504 . . . . 74.44 110.855 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -130.48 178.15 6.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.15 -0.477 . . . . 51.4 110.882 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.421 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 32.1 mt -130.43 132.76 45.88 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.093 -0.503 . . . . 65.53 110.883 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.523 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -127.28 167.53 16.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 52.42 110.907 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 9.2 mtp180 -126.96 138.92 53.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.119 -0.492 . . . . 74.42 110.856 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.511 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 25.2 tttm -59.51 116.76 4.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.465 . . . . 75.1 110.884 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -91.63 -52.93 4.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 73.42 110.86 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.64 ' NZ ' ' CD2' ' A' ' 41' ' ' TYR . 1.8 pttm -160.53 177.84 10.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.125 -0.489 . . . . 74.22 110.862 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -139.33 120.02 14.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.214 -0.448 . . . . 52.43 111.026 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.27 38.16 0.81 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.481 . . . . 54.02 111.082 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 102.73 -89.13 0.7 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.728 -0.749 . . . . 51.22 112.468 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 65.6 tt0 -96.72 -4.43 40.74 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.825 0.345 . . . . 72.14 110.823 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.419 ' HB2' ' HZ2' ' A' ' 39' ' ' LYS . 5.9 mtmp? -113.7 158.61 20.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 73.53 110.855 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.8 t -136.26 119.24 22.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.455 . . . . 72.13 111.107 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.64 ' CD2' ' NZ ' ' A' ' 34' ' ' LYS . 3.3 m-85 -81.31 151.19 28.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 61.41 110.941 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.676 ' CD1' HG23 ' A' ' 58' ' ' THR . 75.4 m95 -141.49 146.32 36.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 73.53 110.912 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 4.7 ptt? -129.26 144.56 51.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 72.34 110.871 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -55.13 108.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.251 -0.432 . . . . 70.23 110.887 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.421 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.9 ptt-85 -39.98 -30.14 0.08 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 74.33 110.9 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -77.88 51.91 0.99 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 71.11 110.849 179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -75.49 -51.8 12.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.252 -0.431 . . . . 62.13 110.909 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -98.0 -13.9 20.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 64.22 111.064 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 mmt-85 -81.82 -61.15 2.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.167 -0.469 . . . . 74.11 110.906 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.3 mt -108.01 26.75 9.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 74.22 110.928 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 38.4 42.45 1.31 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.789 -0.72 . . . . 75.35 112.469 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 5.7 t -96.32 130.01 43.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.79 0.328 . . . . 74.34 110.88 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -111.83 17.78 19.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.156 -0.474 . . . . 71.42 110.841 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 2.9 t -69.51 127.88 34.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 72.03 110.832 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -121.62 173.15 7.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 72.01 110.899 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.744 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -155.52 163.76 39.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.174 -0.466 . . . . 60.32 111.108 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 97.7 mt -128.37 121.71 56.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 64.44 111.089 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.676 HG23 ' CD1' ' A' ' 42' ' ' TRP . 20.1 p -101.08 151.27 22.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 73.45 111.151 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.18 113.14 2.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.178 -0.465 . . . . 72.13 110.866 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 73.48 -101.11 1.13 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.793 -0.718 . . . . 73.51 112.486 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.579 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -127.06 7.12 6.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.736 0.303 . . . . 75.23 110.861 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.664 ' HD2' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -111.06 -175.42 2.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 70.14 110.868 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.8 HD13 ' CG ' ' A' ' 25' ' ' HIS . 20.4 tt -150.89 162.72 3.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 73.21 111.102 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.744 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 1.5 ttp -143.5 148.84 36.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 75.12 110.889 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.6 t -113.64 144.38 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.264 -0.426 . . . . 71.2 111.093 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 14.3 mtp -104.67 -61.61 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.084 -0.507 . . . . 72.23 110.895 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 52.9 mtt-85 -111.44 170.73 7.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.146 -0.479 . . . . 73.41 110.892 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 80.6 p -88.88 -177.91 5.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 75.31 110.858 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 83.9 m-70 -116.01 138.96 50.74 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.067 -0.515 . . . . 74.3 110.866 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 4.3 t -90.98 8.35 35.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.223 -0.444 . . . . 71.32 110.837 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 26.5 p80 -135.59 157.76 46.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.163 -0.471 . . . . 63.32 110.792 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -91.62 151.79 42.76 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.568 0.699 . . . . 62.44 110.878 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 150.24 67.73 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.682 2.255 . . . . 75.21 112.347 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.56 81.37 1.97 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.231 -0.44 . . . . 72.23 110.913 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.443 HD23 ' N ' ' A' ' 75' ' ' LEU . 6.0 mt -48.25 -28.28 2.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 70.51 110.96 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.66 -44.64 77.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 71.52 111.143 179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.98 -29.23 59.25 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.741 -0.742 . . . . 72.52 112.516 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 9.1 tp -76.72 -41.09 46.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.761 0.315 . . . . 54.24 110.914 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -75.52 -23.43 56.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 71.21 110.908 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -80.92 -18.4 47.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 63.04 111.067 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 7.0 mt -80.56 -41.48 24.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.244 -0.435 . . . . 73.5 110.884 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.765 ' HG2' HD21 ' A' ' 14' ' ' LEU . 14.8 mtm180 -56.47 -49.15 75.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 75.21 110.854 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.439 ' HG3' ' N ' ' A' ' 84' ' ' ARG . 0.2 OUTLIER -51.56 -35.46 41.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 71.54 110.88 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.439 ' N ' ' HG3' ' A' ' 83' ' ' GLN . 8.8 mtt-85 -72.81 -20.73 61.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.257 -0.429 . . . . 64.43 110.834 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.448 ' CD ' ' O ' ' A' ' 85' ' ' GLU . 2.2 tp10 -102.11 -14.62 17.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 74.33 110.868 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -106.45 138.92 41.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.142 -0.481 . . . . 64.24 110.812 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.628 ' H ' HD23 ' A' ' 87' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 74.52 110.927 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 112.521 -0.232 . . . . 71.54 112.521 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 m -135.45 155.51 50.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.847 0.356 . . . . 73.22 110.93 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 25.4 t -120.66 -30.54 4.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.16 -0.473 . . . . 70.15 110.877 -179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.1 135.03 4.38 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.701 -0.762 . . . . 75.44 112.473 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.4 p -79.5 -63.59 1.38 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.882 0.372 . . . . 70.14 110.875 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 92.8 p -108.03 87.74 2.57 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.142 -0.481 . . . . 74.45 110.822 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 8' ' ' LEU . . . -62.92 -31.42 80.48 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.715 -0.755 . . . . 72.34 112.509 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.638 HD11 ' HB3' ' A' ' 61' ' ' HIS . 8.0 tp -35.08 96.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.836 0.351 . . . . 70.43 110.894 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.432 ' N ' ' O ' ' A' ' 7' ' ' GLY . 3.8 mmp_? -92.11 144.0 28.45 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.611 0.72 . . . . 75.11 110.907 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.46 ' HA ' ' CD2' ' A' ' 61' ' ' HIS . 54.1 Cg_endo -69.71 173.51 10.82 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.703 2.269 . . . . 74.13 112.3 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 1.032 HD21 HD11 ' A' ' 23' ' ' LEU . 31.5 tp -133.22 144.46 49.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 74.44 110.925 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -98.65 159.9 14.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 71.23 110.853 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -139.31 171.9 13.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.475 . . . . 63.13 110.861 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.607 HD21 ' HG2' ' A' ' 82' ' ' ARG . 11.4 mt -148.16 128.14 13.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.126 -0.488 . . . . 74.21 110.967 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.1 mtp-105 -114.28 131.91 56.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 74.32 110.875 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.3 p -101.16 167.9 9.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 73.4 111.119 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 32.4 t -90.0 -4.22 57.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 72.03 110.821 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.429 HD23 ' N ' ' A' ' 18' ' ' LEU . 5.6 mt -86.13 11.93 10.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 72.23 110.918 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.24 34.72 40.2 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.799 -0.715 . . . . 75.11 112.437 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -136.5 155.33 22.5 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.726 -0.75 . . . . 32.13 112.441 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.0 ttm180 -108.53 164.33 12.44 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.86 0.362 . . . . 72.42 110.899 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.491 ' N ' ' O ' ' A' ' 14' ' ' LEU . 3.0 m-85 -143.76 158.52 43.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 75.34 110.842 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 1.032 HD11 HD21 ' A' ' 11' ' ' LEU . 12.8 tp -126.46 115.85 20.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 75.11 110.903 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.582 HG22 HD12 ' A' ' 14' ' ' LEU . 59.4 t -89.56 122.79 41.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.171 -0.468 . . . . 73.33 111.111 179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.902 ' CG ' HD13 ' A' ' 63' ' ' ILE . 33.7 t60 -161.3 134.04 6.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.204 -0.453 . . . . 64.24 110.907 179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.498 ' HG2' ' CE1' ' A' ' 25' ' ' HIS . 40.4 mm-40 60.19 29.7 19.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.263 -0.426 . . . . 72.24 110.905 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.7 m 65.74 27.71 11.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 74.42 110.845 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.535 ' CE2' ' CD2' ' A' ' 69' ' ' HIS . 16.6 m-85 -126.07 -174.26 3.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.119 -0.491 . . . . 72.14 110.963 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.445 HD21 HD12 ' A' ' 14' ' ' LEU . 40.7 mt -135.31 130.9 35.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.22 110.898 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.468 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 2.0 m-85 -127.42 159.42 34.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.137 -0.483 . . . . 72.54 110.922 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.474 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 3.7 mtt-85 -116.33 148.8 40.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.103 -0.499 . . . . 74.14 110.873 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 41.3 tttp -71.13 109.12 4.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.197 -0.456 . . . . 71.42 110.916 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.475 ' CD ' ' C ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -83.78 -59.6 2.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.432 . . . . 62.41 110.898 179.987 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 33.8 pttt -153.85 -176.37 5.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.49 . . . . 75.33 110.884 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -137.9 119.75 15.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 54.33 111.109 179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.434 ' O ' ' N ' ' A' ' 38' ' ' GLU . . . -102.41 -174.73 2.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.31 -0.404 . . . . 53.44 111.157 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -45.35 93.16 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.722 -0.752 . . . . 72.41 112.506 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.434 ' N ' ' O ' ' A' ' 36' ' ' ALA . 22.0 mt-10 58.68 40.53 23.22 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.905 0.383 . . . . 64.0 110.926 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.5 mtmm -150.93 157.93 43.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 63.3 110.845 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.5 t -135.13 117.45 21.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.172 -0.467 . . . . 71.44 111.175 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -82.3 135.02 35.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 75.11 110.935 -179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.589 ' CD1' HG23 ' A' ' 58' ' ' THR . 75.2 m95 -123.97 161.89 24.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.125 -0.489 . . . . 74.42 110.962 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.2 ptt? -146.12 127.18 14.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.28 -0.418 . . . . 74.01 110.897 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.5 t -41.67 112.43 0.32 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.298 -0.41 . . . . 14.15 110.88 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.474 ' HB2' ' CZ ' ' A' ' 31' ' ' ARG . 19.8 ptt180 -42.28 -46.85 4.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.151 -0.477 . . . . 44.52 110.894 -179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.498 ' HB2' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -80.07 56.7 2.47 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.182 -0.463 . . . . 75.2 110.82 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.417 ' OE1' ' CA ' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -88.99 -38.75 14.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 75.22 110.88 -179.906 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.417 ' CA ' ' OE1' ' A' ' 47' ' ' GLN . . . -89.12 -68.97 0.74 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 70.44 111.099 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 24.0 ttm180 -41.64 -61.87 1.0 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.32 110.801 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.498 HD12 ' HB2' ' A' ' 46' ' ' ASP . 23.4 mt -77.75 -18.93 55.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 65.53 110.898 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 77.96 37.85 28.28 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.75 -0.738 . . . . 64.24 112.452 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.4 t -90.68 143.87 26.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.839 0.352 . . . . 63.01 110.887 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.8 mmt85 -125.54 31.49 5.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.146 -0.479 . . . . 63.42 110.906 -179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.7 t -88.7 137.58 32.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 64.43 110.897 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -125.63 141.87 51.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 75.33 110.938 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -134.46 152.11 51.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 62.24 111.095 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.584 HG22 ' N ' ' A' ' 58' ' ' THR . 91.8 mt -117.64 162.24 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 70.3 111.141 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.589 HG23 ' CD1' ' A' ' 42' ' ' TRP . 43.2 p -141.0 136.89 32.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.475 . . . . 74.2 111.211 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.56 109.43 4.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 75.55 110.874 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 79.16 -101.03 1.81 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.763 -0.732 . . . . 54.43 112.45 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.638 ' HB3' HD11 ' A' ' 8' ' ' LEU . 1.3 t60 -128.96 9.17 5.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.735 0.302 . . . . 74.25 110.841 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.551 ' HG2' HD12 ' A' ' 8' ' ' LEU . 9.1 mmm180 -112.71 -179.82 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.241 -0.436 . . . . 75.51 110.826 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.902 HD13 ' CG ' ' A' ' 25' ' ' HIS . 14.4 tt -146.64 159.83 10.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.124 -0.489 . . . . 75.41 111.142 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.409 ' N ' HG12 ' A' ' 63' ' ' ILE . 36.5 mtm -139.73 152.28 46.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 73.52 110.843 179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 50.3 t -119.62 139.58 46.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.219 -0.446 . . . . 72.54 111.135 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mmm -97.97 -51.79 3.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 74.32 110.868 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 19.3 ttm180 -128.13 172.74 10.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 63.02 110.902 -179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 51.0 p -87.68 -179.04 6.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 72.21 110.861 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.535 ' CD2' ' CE2' ' A' ' 28' ' ' PHE . 86.4 m-70 -111.05 136.56 49.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 65.12 110.902 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.5 p -79.45 -4.17 49.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.214 -0.448 . . . . 71.0 110.862 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.449 ' NE2' ' OD1' ' A' ' 46' ' ' ASP . 12.0 p80 -121.97 178.98 4.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 71.42 110.839 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -109.36 150.21 40.8 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.654 0.74 . . . . 45.3 110.873 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.76 155.29 66.32 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.668 2.246 . . . . 34.31 112.356 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -136.8 100.04 4.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.258 -0.428 . . . . 64.32 110.881 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mt -63.94 -21.42 66.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 73.34 110.875 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -76.51 -61.98 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 75.4 111.138 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.17 -33.49 64.92 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.763 -0.732 . . . . 74.41 112.512 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 tp -72.79 -48.1 40.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.775 0.321 . . . . 73.13 110.948 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -59.73 -29.1 67.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.451 . . . . 74.42 110.832 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.45 -40.33 96.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 25.34 111.132 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.4 mt -75.96 -26.37 56.77 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.283 -0.417 . . . . 73.25 110.972 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.607 ' HG2' HD21 ' A' ' 14' ' ' LEU . 72.7 mtp85 -74.85 -34.17 62.25 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.193 -0.458 . . . . 71.11 110.905 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -58.29 -34.46 70.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 73.44 110.895 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.8 mtt180 -81.3 -3.46 52.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 71.52 110.83 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.87 -31.77 9.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 75.14 110.792 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 9.6 ptt-85 -88.55 8.17 29.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 73.13 110.871 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.657 ' C ' HD22 ' A' ' 87' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.196 -0.456 . . . . 75.15 110.87 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 112.497 -0.241 . . . . 73.24 112.497 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.9 p -82.73 76.13 9.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.848 0.356 . . . . 74.21 110.875 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.7 p -51.6 -51.11 58.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.091 -0.504 . . . . 71.13 110.828 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.93 -94.72 0.42 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.765 -0.731 . . . . 71.31 112.484 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 47.5 t -95.9 74.61 3.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.828 0.347 . . . . 61.21 110.851 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 11.4 t -55.27 123.76 14.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 74.42 110.86 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -127.71 -146.96 6.48 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.725 -0.75 . . . . 72.25 112.504 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.771 ' C ' HD12 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -66.51 100.38 0.66 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.78 0.324 . . . . 62.13 110.875 -179.9 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.56 ' N ' HD12 ' A' ' 8' ' ' LEU . 50.1 mtt180 -86.71 145.12 38.38 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.56 0.695 . . . . 74.43 110.865 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.423 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 54.0 Cg_endo -69.75 -169.89 0.36 Allowed 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.679 2.252 . . . . 60.11 112.355 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.682 HD23 ' CZ ' ' A' ' 13' ' ' PHE . 33.8 tp -151.54 149.49 29.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 73.12 110.91 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -105.33 151.9 23.6 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.183 -0.462 . . . . 72.53 110.891 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.682 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 66.4 m-85 -139.79 172.89 12.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 72.21 110.891 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.704 HD12 ' CG2' ' A' ' 24' ' ' VAL . 5.2 mt -147.27 156.5 42.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.128 -0.487 . . . . 65.3 110.881 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.0 tpp85 -126.03 140.58 52.49 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 74.41 110.806 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.44 ' OG1' ' N ' ' A' ' 20' ' ' GLY . 15.0 p -112.25 148.94 33.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.184 -0.462 . . . . 72.33 111.12 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.6 m -80.75 -46.63 15.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.217 -0.447 . . . . 72.21 110.886 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.1 mp -112.84 64.03 0.63 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.117 -0.492 . . . . 74.04 110.939 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 178.96 -109.31 0.26 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.684 -0.769 . . . . 44.41 112.528 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.44 ' N ' ' OG1' ' A' ' 16' ' ' THR . . . -154.33 -160.51 9.87 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.645 -0.788 . . . . 34.05 112.445 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -87.33 126.15 34.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.791 0.329 . . . . 73.53 110.864 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.421 ' CE1' ' HG2' ' A' ' 31' ' ' ARG . 3.3 m-30 -99.61 167.78 10.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 73.34 110.893 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.493 HD11 HD21 ' A' ' 11' ' ' LEU . 7.0 tp -134.38 132.66 39.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 70.55 110.905 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.704 ' CG2' HD12 ' A' ' 14' ' ' LEU . 55.8 t -98.44 113.35 32.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 74.34 111.128 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.701 ' CG ' HD13 ' A' ' 63' ' ' ILE . 6.2 t60 -149.43 122.67 8.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 74.32 110.838 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 63.46 47.74 3.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.156 -0.474 . . . . 75.14 110.938 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 51.96 25.54 3.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.177 -0.465 . . . . 50.02 110.871 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -123.28 -179.17 4.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.082 -0.508 . . . . 72.45 110.903 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.507 HD21 ' CD1' ' A' ' 14' ' ' LEU . 22.6 mt -131.34 139.09 49.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.186 -0.461 . . . . 73.5 110.949 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.508 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 0.8 OUTLIER -133.16 159.64 39.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.465 . . . . 71.32 110.924 -179.984 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.421 ' HG2' ' CE1' ' A' ' 22' ' ' PHE . 0.6 OUTLIER -123.47 124.57 43.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 62.34 110.912 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 28.2 tttp -46.37 112.94 0.55 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.203 -0.453 . . . . 63.31 110.838 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -90.35 -53.38 4.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.201 -0.454 . . . . 72.03 110.885 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.3 ptmm? -161.25 -176.61 5.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 75.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -143.67 133.3 23.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.27 -0.423 . . . . 43.12 111.075 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -109.82 69.14 0.69 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 64.11 111.079 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.77 -101.08 2.71 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.72 -0.752 . . . . 43.24 112.533 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -101.54 1.18 37.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.87 0.367 . . . . 70.54 110.924 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.409 ' CE ' HG21 ' A' ' 57' ' ' ILE . 48.2 mtpt -112.58 143.69 43.32 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.117 -0.492 . . . . 62.34 110.876 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.89 119.6 60.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 62.53 111.069 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.426 ' N ' ' CD1' ' A' ' 41' ' ' TYR . 6.5 m-30 -78.52 144.59 35.53 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.201 -0.454 . . . . 72.43 110.971 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.487 ' CD1' HG23 ' A' ' 58' ' ' THR . 79.7 m95 -136.08 123.09 21.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 64.11 110.939 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.8 ptt? -106.84 139.75 40.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.255 -0.429 . . . . 53.15 110.894 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 2.0 t -54.03 115.54 2.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 72.33 110.907 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 21.7 ptt-85 -41.59 -34.54 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.208 -0.451 . . . . 75.31 110.834 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -82.82 45.49 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.269 -0.423 . . . . 72.1 110.852 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.726 HE21 ' HB2' ' A' ' 48' ' ' ALA . 4.1 pp0? -87.28 -27.97 22.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 73.43 110.937 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.726 ' HB2' HE21 ' A' ' 47' ' ' GLN . . . -97.85 -25.45 15.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 54.01 111.094 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 23.7 ttm-85 -90.8 -59.97 2.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.253 -0.431 . . . . 74.31 110.87 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.442 ' O ' ' N ' ' A' ' 52' ' ' CYS . 37.8 mt -96.53 22.7 7.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.2 -0.454 . . . . 72.51 110.888 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 37.76 29.63 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.822 -0.704 . . . . 75.34 112.536 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.442 ' N ' ' O ' ' A' ' 50' ' ' LEU . 4.7 t -80.92 99.32 8.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.827 0.346 . . . . 72.01 110.871 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 30.3 mmm-85 -80.6 7.38 10.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 74.25 110.869 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.9 t -54.82 110.92 0.72 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.216 -0.447 . . . . 54.42 110.83 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 24.4 mtt180 -112.36 166.97 10.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 64.41 110.916 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.692 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -148.36 166.67 27.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 53.51 111.11 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.409 HG21 ' CE ' ' A' ' 39' ' ' LYS . 86.8 mt -132.47 123.58 50.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 65.24 111.063 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.487 HG23 ' CD1' ' A' ' 42' ' ' TRP . 49.1 p -102.91 153.5 20.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.48 . . . . 64.53 111.161 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -153.12 109.82 3.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.215 -0.448 . . . . 51.23 110.857 -179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 71.46 -96.73 0.65 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.703 -0.761 . . . . 63.13 112.505 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.66 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -128.07 9.17 6.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.788 0.328 . . . . 71.12 110.857 -179.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.466 ' HG3' HD13 ' A' ' 8' ' ' LEU . 14.8 mtp-105 -110.99 -176.92 3.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 64.14 110.858 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.701 HD13 ' CG ' ' A' ' 25' ' ' HIS . 19.4 tt -148.03 160.58 7.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.454 . . . . 63.44 111.072 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.692 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 8.1 ttp -142.53 148.44 37.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.157 -0.474 . . . . 74.42 110.847 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 93.4 t -118.57 141.97 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 72.12 111.091 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 9.4 mmm -105.59 -61.93 1.43 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 60.21 110.886 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.418 ' HD3' ' N ' ' A' ' 68' ' ' SER . 1.9 tmt_? -114.03 148.61 36.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 64.33 110.875 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.418 ' N ' ' HD3' ' A' ' 67' ' ' ARG . 13.7 p -68.73 -175.5 0.7 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 62.03 110.906 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -112.07 142.86 43.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.201 -0.454 . . . . 74.2 110.812 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 5.3 t -92.39 9.16 35.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.138 -0.483 . . . . 73.1 110.807 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 28.5 p80 -138.97 161.3 37.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 71.02 110.835 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -94.23 155.43 39.93 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.609 0.718 . . . . 64.41 110.945 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.82 155.55 65.43 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.709 2.273 . . . . 64.14 112.32 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -134.46 80.25 1.84 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 72.25 110.83 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.596 HD23 ' N ' ' A' ' 75' ' ' LEU . 0.7 OUTLIER -46.57 -24.16 0.49 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 75.02 110.947 -179.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -70.53 -50.97 32.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.143 -0.481 . . . . 74.31 111.131 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.32 -37.88 80.62 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.679 -0.772 . . . . 63.53 112.473 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.434 HD21 HH11 ' A' ' 82' ' ' ARG . 6.0 tp -69.7 -41.8 74.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.779 0.323 . . . . 63.11 110.918 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -60.96 -23.3 65.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.137 -0.483 . . . . 70.34 110.845 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.75 -60.56 2.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 53.21 111.065 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.2 mt -52.86 -45.92 67.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.188 -0.46 . . . . 71.44 110.948 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.504 ' HG2' HD21 ' A' ' 14' ' ' LEU . 36.4 mtp180 -64.42 -24.3 67.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.46 . . . . 71.24 110.907 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -85.0 -31.8 23.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 72.24 110.917 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -72.49 -18.64 61.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 74.01 110.838 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -77.85 -35.94 50.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 63.21 110.945 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 4.8 mmp_? -90.57 52.52 2.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.115 -0.493 . . . . 72.41 110.836 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 116.209 -0.45 . . . . 73.23 110.94 179.99 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 112.425 -0.27 . . . . 63.52 112.425 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.2 p -124.87 130.19 51.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.902 0.382 . . . . 62.34 110.822 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 m -134.55 177.29 7.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.086 -0.506 . . . . 71.0 110.934 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.39 -167.2 22.46 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.707 -0.758 . . . . 73.31 112.464 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.6 m -92.39 161.79 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.922 0.392 . . . . 65.43 110.857 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 14.3 m -105.73 17.09 24.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 74.12 110.916 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -90.81 -51.21 2.7 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.755 -0.736 . . . . 75.44 112.557 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.54 HD12 ' HG3' ' A' ' 62' ' ' ARG . 15.2 tp -76.7 92.52 3.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.811 0.338 . . . . 65.21 110.928 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -82.09 144.0 50.18 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.687 0.756 . . . . 70.54 110.79 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.448 ' HA ' ' CG ' ' A' ' 61' ' ' HIS . 54.0 Cg_endo -69.76 -171.06 0.43 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.633 2.222 . . . . 72.55 112.37 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.853 HD21 HD11 ' A' ' 23' ' ' LEU . 15.4 tp -148.92 151.98 35.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.212 -0.449 . . . . 75.31 110.923 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -105.41 141.52 36.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 72.22 110.87 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.647 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 19.7 m-85 -139.36 170.18 16.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 75.42 110.921 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 mt -143.72 146.59 33.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.155 -0.475 . . . . 72.03 110.888 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 62.0 mtp85 -121.74 114.16 20.71 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 74.4 110.909 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -122.24 138.18 54.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.273 -0.422 . . . . 72.32 111.143 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.7 t -46.98 -57.93 4.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.259 -0.428 . . . . 64.2 110.831 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.402 ' N ' ' CD2' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -86.33 145.03 27.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 75.42 110.921 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.94 -30.96 4.12 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.776 -0.726 . . . . 51.13 112.518 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 103.23 -128.04 9.39 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.747 -0.74 . . . . 60.35 112.476 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 -103.43 156.39 17.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.812 0.339 . . . . 75.22 110.909 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -129.69 158.81 38.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 71.1 110.873 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.853 HD11 HD21 ' A' ' 11' ' ' LEU . 11.2 tp -122.22 115.34 22.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.194 -0.457 . . . . 65.32 110.908 -179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.5 t -89.95 116.33 31.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.246 -0.434 . . . . 72.21 111.158 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.806 ' CG ' HD13 ' A' ' 63' ' ' ILE . 14.3 t60 -153.97 129.25 9.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 71.53 110.889 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 62.66 37.76 12.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 74.41 110.904 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m 60.19 26.1 15.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.127 -0.488 . . . . 51.14 110.901 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.468 ' CE1' ' CE1' ' A' ' 71' ' ' HIS . 13.4 m-85 -126.82 -176.82 3.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 74.25 110.859 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.43 ' CB ' ' HD3' ' A' ' 45' ' ' ARG . 14.7 mt -134.33 134.25 41.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 63.41 110.915 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.508 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.1 m-85 -129.16 169.16 15.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.249 -0.432 . . . . 74.54 110.99 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -129.32 138.01 51.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.869 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.478 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 38.3 tttt -61.88 113.33 2.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 72.22 110.911 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -88.62 -47.56 8.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 74.43 110.909 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -157.28 169.27 25.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.14 -0.482 . . . . 74.14 110.906 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -134.72 123.14 23.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 73.0 111.152 179.786 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.3 34.73 1.39 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.449 . . . . 71.35 111.12 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.64 -88.7 0.94 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.708 -0.758 . . . . 64.24 112.537 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -92.29 -0.22 57.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.891 0.377 . . . . 63.33 110.883 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -121.6 157.78 30.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 72.12 110.837 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.456 ' CG1' ' HG3' ' A' ' 32' ' ' LYS . 2.5 t -138.46 112.9 8.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.236 -0.438 . . . . 70.53 111.123 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -77.11 139.3 39.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.114 -0.493 . . . . 71.11 110.978 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.585 ' CG ' HD22 ' A' ' 23' ' ' LEU . 81.6 m95 -128.48 165.98 19.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.148 -0.478 . . . . 63.35 110.889 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -151.84 140.68 20.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 73.53 110.919 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.0 t -51.06 106.55 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.228 -0.442 . . . . 71.03 110.872 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.43 ' HD3' ' CB ' ' A' ' 29' ' ' LEU . 18.3 ptt-85 -40.17 -33.63 0.25 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 63.34 110.844 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -76.97 52.35 0.86 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.449 . . . . 65.52 110.874 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -73.12 -50.83 20.55 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.232 -0.44 . . . . 71.52 110.886 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -97.19 -10.01 26.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 74.21 111.028 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.3 ttt180 -84.03 -60.34 2.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 74.52 110.847 -179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 52' ' ' CYS . 94.3 mt -106.78 25.62 11.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.187 -0.461 . . . . 74.5 110.956 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 42.73 23.25 0.18 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.754 -0.736 . . . . 35.52 112.528 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.417 ' N ' ' O ' ' A' ' 50' ' ' LEU . 6.1 t -77.46 141.44 39.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.791 0.329 . . . . 72.02 110.861 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.13 22.32 9.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.139 -0.482 . . . . 71.45 110.861 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.521 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 47.8 t -66.42 135.45 54.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.221 -0.445 . . . . 53.03 110.843 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 -128.72 160.5 32.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.086 -0.506 . . . . 71.23 110.839 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.445 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -154.86 150.3 27.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 25.41 111.067 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.463 HD12 ' CE ' ' A' ' 66' ' ' MET . 51.5 mt -120.38 131.61 72.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.22 -0.446 . . . . 74.34 111.152 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.423 HG23 ' CD1' ' A' ' 42' ' ' TRP . 36.6 p -108.88 144.5 36.7 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 74.04 111.134 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -134.06 87.09 2.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.241 -0.436 . . . . 73.35 110.947 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 85.45 -87.07 1.55 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.753 -0.737 . . . . 73.41 112.413 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.492 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.4 OUTLIER -126.25 -10.76 6.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.755 0.312 . . . . 70.34 110.871 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.54 ' HG3' HD12 ' A' ' 8' ' ' LEU . 51.8 mtm180 -92.4 -179.96 5.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.452 . . . . 74.42 110.951 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.806 HD13 ' CG ' ' A' ' 25' ' ' HIS . 19.8 tt -150.92 158.91 4.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 73.21 111.151 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.445 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 2.4 ttp -144.14 142.01 30.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 62.23 110.882 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 23.0 t -102.53 140.75 20.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 71.04 111.132 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.463 ' CE ' HD12 ' A' ' 57' ' ' ILE . 26.3 mmm -113.35 -64.12 1.35 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.088 -0.506 . . . . 73.44 110.917 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 tpp180 -101.58 137.29 40.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 71.1 110.912 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 85.2 p -69.29 177.83 2.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.213 -0.449 . . . . 61.42 110.86 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.521 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 47.4 m-70 -111.52 145.74 38.53 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.102 -0.499 . . . . 72.32 110.886 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 8.6 t -97.44 13.78 28.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.207 -0.451 . . . . 70.12 110.955 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . 0.468 ' CE1' ' CE1' ' A' ' 28' ' ' PHE . 28.3 p80 -140.67 178.87 7.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.497 . . . . 62.42 110.833 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -111.46 152.2 43.78 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.589 0.709 . . . . 72.2 110.878 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.412 ' HA ' ' CE1' ' A' ' 28' ' ' PHE . 53.9 Cg_endo -69.77 157.31 60.8 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.654 2.236 . . . . 63.22 112.328 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -135.93 83.64 2.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 75.35 110.841 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 12.6 mt -47.42 -29.54 2.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.227 -0.442 . . . . 71.23 110.901 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.96 -51.15 50.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.49 . . . . 52.12 111.162 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.65 -41.77 98.94 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.747 -0.739 . . . . 41.25 112.457 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tp -68.56 -51.51 41.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.793 0.33 . . . . 42.11 110.924 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -50.61 -22.59 2.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 73.44 110.858 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.781 ' HB1' ' NH1' ' A' ' 84' ' ' ARG . . . -69.55 -67.81 0.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 74.42 111.06 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.414 ' C ' ' O ' ' A' ' 80' ' ' ALA . 6.6 mt -37.4 -52.31 1.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 65.02 110.904 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.5 mtm180 -52.5 -56.58 14.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.202 -0.453 . . . . 74.24 110.848 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.445 ' CD ' ' O ' ' A' ' 83' ' ' GLN . 0.6 OUTLIER -66.62 -19.18 65.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 74.33 110.956 -179.914 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.781 ' NH1' ' HB1' ' A' ' 80' ' ' ALA . 16.7 mtt85 -86.14 -27.88 24.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 74.32 110.834 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -69.75 -40.56 76.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 73.4 110.865 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -122.89 169.61 10.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 74.32 110.909 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 24.3 tp . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 74.43 110.917 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 112.501 -0.24 . . . . 32.22 112.501 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.6 t -151.05 120.28 6.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.9 0.381 . . . . 52.21 110.936 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.5 t -69.12 102.73 1.72 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.494 . . . . 65.53 110.852 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -38.55 135.91 1.13 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.811 -0.709 . . . . 63.3 112.453 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.5 t -96.96 134.93 39.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.858 0.361 . . . . 54.4 110.921 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 35.1 t -92.34 2.44 56.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.475 . . . . 74.41 110.83 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 157.31 -116.42 0.72 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.753 -0.736 . . . . 71.43 112.506 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.713 ' C ' HD12 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -153.97 133.53 12.86 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.794 0.33 . . . . 70.51 110.973 -179.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.647 ' O ' HD12 ' A' ' 8' ' ' LEU . 61.0 mtp85 -66.68 143.77 98.28 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.581 0.705 . . . . 75.14 110.87 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.417 ' HB3' ' NE2' ' A' ' 61' ' ' HIS . 53.3 Cg_endo -69.82 -170.78 0.42 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.687 2.258 . . . . 74.24 112.312 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.668 HD21 HD11 ' A' ' 23' ' ' LEU . 27.9 tp -130.62 143.88 51.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 64.15 110.909 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -88.06 134.4 33.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 74.12 110.915 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.654 ' CZ ' HD23 ' A' ' 11' ' ' LEU . 64.2 m-85 -133.56 172.87 12.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.123 -0.49 . . . . 74.35 110.886 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.621 HD12 ' CG2' ' A' ' 24' ' ' VAL . 10.9 mt -146.82 150.26 34.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.158 -0.474 . . . . 54.51 110.891 -179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.3 ttm-85 -127.54 116.44 20.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.466 . . . . 73.23 110.838 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.475 HG21 ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -122.14 150.34 42.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.165 -0.471 . . . . 63.05 111.168 -179.938 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.8 t -80.8 -52.71 7.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 70.2 110.885 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.3 mt -80.95 67.66 6.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.129 -0.487 . . . . 74.42 110.873 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 159.02 -54.58 0.36 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.732 -0.747 . . . . 65.31 112.456 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 132.44 -128.53 5.23 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.722 -0.751 . . . . 74.12 112.492 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 tpp85 -106.07 136.26 46.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.898 0.38 . . . . 73.13 110.83 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.475 ' CE2' HG21 ' A' ' 16' ' ' THR . 2.7 m-85 -117.01 158.19 24.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.45 . . . . 74.44 110.943 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.668 HD11 HD21 ' A' ' 11' ' ' LEU . 13.7 tp -124.88 115.99 21.51 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 75.13 110.939 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.621 ' CG2' HD12 ' A' ' 14' ' ' LEU . 41.4 t -90.62 113.53 26.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 71.12 111.107 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.627 ' CG ' HD13 ' A' ' 63' ' ' ILE . 15.3 t60 -148.43 124.51 10.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 71.43 110.868 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 62.73 44.37 6.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 74.1 110.87 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.6 m 55.79 25.27 8.21 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 62.53 110.793 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -125.99 172.93 9.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 70.44 110.86 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.474 HD13 ' CZ ' ' A' ' 45' ' ' ARG . 33.5 mt -125.94 134.45 51.54 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.151 -0.477 . . . . 62.31 110.92 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.6 m-85 -127.75 167.3 16.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.187 -0.46 . . . . 74.4 110.912 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -132.6 133.37 43.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.13 -0.486 . . . . 74.23 110.903 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.533 ' N ' ' CE3' ' A' ' 42' ' ' TRP . 73.5 tttt -55.81 114.92 2.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.246 -0.434 . . . . 72.31 110.935 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -88.88 -57.22 2.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.245 -0.434 . . . . 73.33 110.842 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.529 ' HD2' ' CG ' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -151.45 -177.69 6.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 64.35 110.85 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -132.92 138.92 47.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.461 . . . . 74.45 111.124 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -110.72 35.98 3.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.195 -0.457 . . . . 61.31 111.107 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.1 -78.59 0.52 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.843 -0.694 . . . . 72.12 112.466 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -105.02 -20.4 13.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.91 0.386 . . . . 74.15 110.875 -179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -98.98 163.94 12.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.197 -0.456 . . . . 64.33 110.902 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.0 t -134.32 120.68 34.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 61.42 111.104 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.529 ' CG ' ' HD2' ' A' ' 34' ' ' LYS . 2.9 m-85 -79.34 142.26 36.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.111 -0.495 . . . . 75.5 110.878 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.533 ' CE3' ' N ' ' A' ' 32' ' ' LYS . 80.6 m95 -134.93 150.69 50.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.082 -0.508 . . . . 72.1 110.905 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 6.8 ptt? -133.06 138.03 46.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 53.24 110.876 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.403 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.9 t -51.3 104.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 61.33 110.895 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.474 ' CZ ' HD13 ' A' ' 29' ' ' LEU . 15.9 ptt180 -40.47 -28.4 0.07 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 72.31 110.829 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 44' ' ' CYS . 2.9 m-20 -87.86 48.49 1.65 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.248 -0.433 . . . . 71.44 110.882 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -83.3 -40.45 19.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.198 -0.456 . . . . 75.32 110.892 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -93.37 -9.55 38.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.448 . . . . 65.03 111.071 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -97.33 -55.26 2.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.228 -0.442 . . . . 73.51 110.838 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.436 ' O ' ' C ' ' A' ' 51' ' ' GLY . 28.4 mt -106.69 26.9 9.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.201 -0.454 . . . . 75.2 110.938 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.436 ' C ' ' O ' ' A' ' 50' ' ' LEU . . . 34.62 56.13 0.78 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.677 -0.773 . . . . 61.4 112.529 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.6 t -126.47 118.34 24.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.835 0.35 . . . . 54.12 110.893 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 45.9 mmt-85 -93.44 2.74 56.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.205 -0.452 . . . . 74.42 110.874 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.468 ' OG ' ' CE1' ' A' ' 69' ' ' HIS . 37.8 t -40.82 105.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 72.11 110.871 -179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -102.93 -179.74 4.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 74.1 110.878 -179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.812 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -162.62 167.04 23.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.44 . . . . 74.32 111.15 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 57.8 mt -131.52 123.89 53.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.287 -0.415 . . . . 70.21 111.11 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.84 HG22 HG13 ' A' ' 63' ' ' ILE . 31.3 p -108.92 141.19 41.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 75.31 111.133 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -147.24 111.54 5.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 70.53 110.886 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.73 -102.42 2.35 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.823 -0.704 . . . . 63.24 112.507 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.644 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -129.0 10.35 5.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.786 0.327 . . . . 74.0 110.87 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.606 ' CD ' HD13 ' A' ' 8' ' ' LEU . 1.5 mmp_? -113.27 -174.99 2.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 74.22 110.893 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.84 HG13 HG22 ' A' ' 58' ' ' THR . 18.5 tt -150.02 152.8 11.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 72.35 111.117 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.812 ' O ' ' HB1' ' A' ' 56' ' ' ALA . 21.4 mtm -134.52 148.77 50.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 62.33 110.878 179.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.3 t -117.23 138.21 48.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 63.41 111.093 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 11.2 mtp -107.96 -54.69 2.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.485 . . . . 65.45 110.923 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.74 160.52 14.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 63.23 110.898 -179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 p -95.75 167.04 11.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 72.33 110.844 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.468 ' CE1' ' OG ' ' A' ' 54' ' ' SER . 38.0 m-70 -104.07 129.97 51.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 74.45 110.82 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 7.0 t -89.06 13.11 13.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.163 -0.471 . . . . 55.21 110.868 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 19.1 p80 -133.34 172.79 12.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.224 -0.444 . . . . 74.11 110.837 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -104.65 151.41 39.27 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.711 . . . . 75.34 110.926 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 151.6 69.06 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.666 2.244 . . . . 73.24 112.303 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -112.7 81.76 1.54 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.189 -0.46 . . . . 54.11 110.834 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.9 mt -51.33 -17.69 0.8 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 52.14 110.857 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -89.86 -55.1 3.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.224 -0.444 . . . . 31.52 111.12 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.99 -37.52 91.59 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.717 -0.754 . . . . 52.3 112.526 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 12.6 tp -68.87 -51.01 44.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.779 0.323 . . . . 65.21 110.946 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -53.34 -30.93 41.92 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.141 -0.481 . . . . 75.2 110.87 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.05 -28.54 66.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 41.32 111.09 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 3.7 mt -79.2 -39.02 34.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.233 -0.44 . . . . 72.3 110.885 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.506 ' HG2' HD21 ' A' ' 14' ' ' LEU . 4.0 mtp-105 -72.88 -42.68 63.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 72.51 110.847 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.472 ' CG ' ' N ' ' A' ' 84' ' ' ARG . 2.4 pt20 -60.1 -46.37 89.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 72.31 110.9 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.472 ' N ' ' CG ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER -67.99 -32.28 72.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.25 -0.432 . . . . 75.13 110.863 -179.901 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 84' ' ' ARG . 0.9 OUTLIER -34.46 -48.79 0.37 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 74.15 110.885 -179.935 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 65.2 mtp180 -87.14 154.48 20.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.1 -0.5 . . . . 64.51 110.824 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 8.2 mp . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.486 . . . . 65.24 110.904 -179.975 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.364 0 N-CA-C 112.552 -0.219 . . . . 55.42 112.552 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 t -50.5 95.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.93 0.395 . . . . 64.1 110.802 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.7 m -121.11 161.33 21.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.129 -0.487 . . . . 54.32 110.858 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 177.43 177.57 46.39 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.687 -0.768 . . . . 23.23 112.477 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.6 t -98.04 -34.99 10.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.945 0.402 . . . . 75.15 110.883 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.8 p -110.14 97.3 6.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.091 -0.504 . . . . 73.1 110.859 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 174.88 -122.1 0.86 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.75 -0.738 . . . . 73.23 112.502 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.839 HD12 ' HG3' ' A' ' 62' ' ' ARG . 0.5 OUTLIER -124.99 174.46 7.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.775 0.321 . . . . 73.43 110.971 -179.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.466 ' CG ' ' HD2' ' A' ' 10' ' ' PRO . 16.1 ttm180 -106.14 143.23 26.51 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.603 0.716 . . . . 75.0 110.913 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.466 ' HD2' ' CG ' ' A' ' 9' ' ' ARG . 54.5 Cg_endo -69.75 -170.04 0.37 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.619 2.213 . . . . 71.4 112.417 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.553 HD22 ' HB ' ' A' ' 63' ' ' ILE . 11.8 tp -151.27 147.81 27.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 74.31 110.872 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 13' ' ' PHE . 8.1 tp10 -103.56 146.57 28.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 74.23 110.958 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.409 ' N ' ' HG3' ' A' ' 12' ' ' GLU . 25.7 m-85 -139.44 172.93 12.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.199 -0.455 . . . . 72.22 110.84 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.9 mt -142.06 157.68 44.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 73.04 110.905 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.426 ' HD2' ' N ' ' A' ' 15' ' ' ARG . 2.5 mpt_? -125.3 119.55 28.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.254 -0.43 . . . . 72.42 110.849 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.65 132.83 54.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 70.0 111.128 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 17.9 m -64.73 -24.77 67.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 44.33 110.859 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.833 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -114.82 81.04 1.5 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 63.34 110.927 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 149.72 -24.95 1.18 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.758 -0.734 . . . . 70.42 112.484 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.51 -96.95 1.32 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.76 -0.733 . . . . 65.41 112.493 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 tpp180 -134.73 137.78 43.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.817 0.341 . . . . 71.12 110.892 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -112.55 159.75 18.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.29 -0.414 . . . . 74.13 110.927 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.406 HD11 HD21 ' A' ' 11' ' ' LEU . 6.7 tp -131.96 130.72 41.84 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 73.3 110.953 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.7 t -97.1 111.43 27.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 44.22 111.137 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.663 ' CD2' HD13 ' A' ' 63' ' ' ILE . 2.3 t60 -148.05 129.55 14.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.429 . . . . 75.3 110.855 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 59.88 38.59 21.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 73.14 110.892 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 m 61.22 18.29 9.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.136 -0.484 . . . . 73.31 110.863 -179.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -116.71 179.53 3.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 65.03 110.85 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 27.9 mt -130.37 135.4 48.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.16 -0.473 . . . . 74.14 110.886 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.499 ' CD1' ' N ' ' A' ' 30' ' ' TYR . 1.2 m-85 -128.37 163.01 25.78 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.278 -0.419 . . . . 74.25 110.911 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 16.4 mtt180 -117.48 126.55 52.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 70.31 110.808 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.509 ' HB2' ' CZ3' ' A' ' 42' ' ' TRP . 54.2 tttt -54.55 110.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 71.45 110.882 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.429 ' CD ' ' C ' ' A' ' 33' ' ' GLU . 0.0 OUTLIER -81.38 -58.63 2.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 61.14 110.934 179.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.83 -177.57 5.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.163 -0.471 . . . . 75.15 110.884 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -141.03 109.31 5.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.205 -0.452 . . . . 64.13 111.13 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.61 90.31 7.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.227 -0.442 . . . . 71.33 111.083 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 58.35 -92.89 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.737 -0.744 . . . . 74.43 112.505 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.446 ' N ' ' CD ' ' A' ' 38' ' ' GLU . 9.1 mp0 -106.99 9.97 30.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.933 0.397 . . . . 74.11 110.871 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 42.5 mtmt -116.48 155.76 28.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.193 -0.458 . . . . 63.34 110.96 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 15.4 t -134.51 122.6 40.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.313 -0.403 . . . . 55.33 111.139 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -87.18 141.8 28.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.465 . . . . 63.41 110.851 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' TRP . . . . . 0.509 ' CZ3' ' HB2' ' A' ' 32' ' ' LYS . 67.5 m95 -135.29 163.38 30.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.082 -0.508 . . . . 75.3 110.94 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 12.3 ptt? -150.17 140.36 22.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.3 -0.409 . . . . 73.55 110.919 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.8 t -52.85 107.58 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 73.12 110.889 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 19.1 ptt-85 -40.23 -31.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 75.22 110.947 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -81.96 43.92 0.81 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.155 -0.475 . . . . 75.41 110.888 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -85.33 -34.93 21.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.209 -0.45 . . . . 72.25 110.866 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -96.24 -14.97 22.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.274 -0.421 . . . . 63.42 111.035 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -97.04 -58.72 1.95 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.271 -0.422 . . . . 71.0 110.901 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.0 mt -99.49 21.9 11.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 75.21 110.926 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 41.56 37.82 1.97 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.764 -0.732 . . . . 73.31 112.43 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 30.9 t -93.87 110.42 22.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.82 0.343 . . . . 41.14 110.838 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.414 ' O ' ' CD ' ' A' ' 55' ' ' ARG . 0.9 OUTLIER -91.94 19.38 6.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 74.01 110.893 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.5 t -63.09 108.49 1.25 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 73.51 110.92 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.469 ' HB3' ' HE2' ' A' ' 66' ' ' MET . 1.1 mpt_? -107.06 156.4 18.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 71.34 110.888 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.475 ' HB1' ' O ' ' A' ' 64' ' ' MET . . . -138.8 167.68 21.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.31 111.117 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.778 ' HB ' ' HE3' ' A' ' 64' ' ' MET . 55.2 mt -141.57 123.42 13.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.192 -0.458 . . . . 65.23 111.104 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.824 HG22 HG13 ' A' ' 63' ' ' ILE . 18.4 p -109.33 149.94 28.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.113 -0.494 . . . . 71.44 111.149 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.47 89.06 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 72.41 110.867 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 86.61 -87.56 1.56 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.733 -0.746 . . . . 71.2 112.477 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . 0.477 ' CE1' ' H ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER -126.5 -8.19 6.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.817 0.341 . . . . 52.13 110.898 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.839 ' HG3' HD12 ' A' ' 8' ' ' LEU . 21.6 mtt180 -91.4 -177.4 4.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 65.14 110.855 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.824 HG13 HG22 ' A' ' 58' ' ' THR . 5.9 tt -150.49 153.8 9.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 73.22 111.122 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 0.778 ' HE3' ' HB ' ' A' ' 57' ' ' ILE . 3.6 tmm? -138.87 151.52 47.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.13 -0.486 . . . . 71.2 110.85 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.7 t -111.58 134.07 55.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 75.23 111.173 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.469 ' HE2' ' HB3' ' A' ' 55' ' ' ARG . 13.0 mtm -103.26 -36.03 8.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 60.21 110.871 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 12.9 mmt180 -140.05 160.18 40.51 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.245 -0.434 . . . . 75.15 110.899 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.2 m -86.11 -179.52 6.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.186 -0.461 . . . . 74.01 110.826 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 70.6 m-70 -113.15 137.44 51.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 71.42 110.844 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.8 t -94.24 14.27 20.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.248 -0.433 . . . . 61.41 110.883 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -140.69 173.6 11.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.151 -0.477 . . . . 71.43 110.822 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 -106.34 152.29 40.5 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.589 0.709 . . . . 60.43 110.832 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 167.02 25.71 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.719 2.279 . . . . 74.45 112.358 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -144.35 82.93 1.71 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.28 -0.418 . . . . 72.43 110.866 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.1 mt -47.03 -25.47 0.83 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 72.31 110.895 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.25 -42.52 83.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 74.05 111.102 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -79.61 -38.31 21.0 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.777 -0.725 . . . . 72.12 112.468 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 tp -67.64 -41.45 83.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.75 0.309 . . . . 43.23 110.915 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -63.81 -25.56 68.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.192 -0.458 . . . . 75.2 110.906 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.39 -51.6 59.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 41.51 111.138 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 4.2 mt -64.18 -30.78 71.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 74.3 110.869 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mtp-105 -81.23 -20.78 40.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.446 . . . . 62.24 110.92 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.16 -32.97 59.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 73.43 110.937 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -86.56 -7.74 58.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 72.2 110.885 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -108.92 -12.78 14.84 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.198 -0.455 . . . . 64.13 110.896 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.402 ' O ' ' CZ ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER -94.18 17.75 12.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 75.23 110.89 -179.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.186 -0.461 . . . . 64.41 110.932 -179.998 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_