data_2pph_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 2pph _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 ' 3' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 . . . . . 0 C--O 1.233 0.217 0 CA-C-O 121.051 0.453 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.0 t -82.07 134.81 26.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.799 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.2 ttm105 -97.97 113.01 24.73 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.531 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.0 mp -114.61 134.09 58.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.185 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -104.33 114.66 29.04 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.878 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -102.52 143.45 32.2 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.153 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.418 ' HG3' ' HG3' ' A' ' 14' ' ' ARG . 36.7 tt0 -133.01 129.51 38.25 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.344 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -139.24 115.1 10.12 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.518 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.02 34.28 23.44 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.234 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.44 -14.24 61.71 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 120.995 -0.622 . . . . 0.0 113.253 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -85.06 119.43 25.44 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.996 0.398 . . . . 0.0 110.641 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.418 ' HG3' ' HG3' ' A' ' 9' ' ' GLU . 2.7 mpt_? -100.05 149.01 23.92 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.195 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.4 mtp-105 -144.41 143.73 31.06 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.32 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mt -103.01 118.85 50.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.842 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 34.1 mt -128.97 135.92 60.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-O 120.77 0.319 . . . . 0.0 111.24 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.15 140.92 37.59 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.337 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -128.3 119.77 25.75 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.026 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.2 t -73.61 125.77 28.78 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.017 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -63.15 148.21 93.31 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.237 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.19 134.01 33.4 Favored 'Cis proline' 0 C--N 1.35 0.612 0 C-N-CA 123.33 -1.529 . . . . 0.0 112.61 0.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.6 p -79.58 114.28 20.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 121.014 0.435 . . . . 0.0 110.948 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.53 140.64 36.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.197 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -59.15 -38.47 79.76 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.929 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.44 -45.06 95.03 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.637 0.256 . . . . 0.0 111.099 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.29 -42.33 88.53 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.179 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.33 -48.99 57.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.07 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.75 -44.53 96.72 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.444 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -58.52 -39.0 78.92 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.559 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.05 -47.61 70.81 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.761 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.51 -44.34 99.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.149 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.8 m -62.43 -39.1 92.22 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.23 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.0 m -71.68 -45.08 63.02 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 121.253 -0.179 . . . . 0.0 111.467 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 50.8 t -60.14 -50.19 81.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.492 0.187 . . . . 0.0 111.373 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -82.33 -25.24 34.07 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.05 22.05 69.44 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.996 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -152.63 152.0 27.92 Favored Pre-proline 0 N--CA 1.463 0.217 0 CA-C-N 116.949 0.374 . . . . 0.0 110.997 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.64 85.0 1.16 Allowed 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.599 2.2 . . . . 0.0 112.131 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.7 mp -85.83 145.09 27.36 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.225 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -97.78 139.73 33.22 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.952 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.8 mt -98.54 127.83 44.63 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.981 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -115.31 116.29 28.05 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.082 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -91.87 108.15 19.72 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.894 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -104.99 117.5 34.16 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.476 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -76.32 -59.97 2.54 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.785 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -178.38 -51.04 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.265 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -103.58 -31.98 9.66 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.522 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.5 tp -119.8 156.4 30.7 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.805 0.336 . . . . 0.0 111.637 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.9 t -116.74 131.28 56.99 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.136 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.9 mm -114.29 133.84 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.977 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.412 ' CD2' ' HG2' ' A' ' 54' ' ' LYS . 5.7 tt -96.55 135.19 38.79 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.768 0.318 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.0 mt -87.83 102.1 14.36 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.176 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.412 ' HG2' ' CD2' ' A' ' 52' ' ' LEU . 0.0 OUTLIER -106.35 -35.17 7.22 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.349 179.74 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 22.9 p30 -142.8 -179.94 6.63 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.314 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -61.2 -33.62 73.76 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.814 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -53.06 -42.82 66.17 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.951 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -65.28 -44.59 87.54 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.903 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.81 -40.15 83.87 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.09 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.21 -43.25 99.18 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.781 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -64.48 -44.0 92.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.416 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.23 -45.67 92.31 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.864 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.0 mt -66.47 -42.16 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 120.556 0.217 . . . . 0.0 110.925 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -56.76 -45.63 81.95 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.244 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 15.9 mt -70.28 -41.24 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.235 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.25 -46.85 88.67 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.952 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.3 -38.43 89.35 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.733 0.302 . . . . 0.0 110.83 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 mmm180 -62.43 -33.75 75.42 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.281 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.9 t -87.69 103.12 15.3 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.978 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 85.5 p -61.78 -31.95 72.19 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.288 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.7 m -60.32 -42.74 96.24 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.924 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mtt -68.61 151.41 46.77 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.119 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -135.83 -64.74 0.61 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.212 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.36 173.0 8.99 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.023 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.9 mp -112.97 125.82 54.81 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.103 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 mtt-85 -92.57 107.49 19.25 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.711 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.4 mt -129.59 132.25 66.37 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.868 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.3 tp -102.08 127.38 49.0 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.71 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.6 mt -93.67 127.71 39.5 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.099 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mp -132.5 142.97 49.44 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.867 0.365 . . . . 0.0 111.375 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.463 0.21 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.968 179.879 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.766 0.317 . . . . 0.0 110.818 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 39.5 t -71.82 131.05 35.11 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.107 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -86.65 110.45 19.86 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.96 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 21.7 mt -113.56 129.46 69.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.95 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -100.85 123.26 44.78 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.812 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -115.54 133.46 56.02 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.009 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -134.1 127.63 32.52 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.909 0.385 . . . . 0.0 111.326 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -148.43 131.19 16.02 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.59 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 60.51 29.54 19.09 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.266 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.29 -13.86 59.0 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.857 -0.687 . . . . 0.0 113.288 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -83.22 107.74 15.97 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 117.056 0.428 . . . . 0.0 110.942 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.0 ptt180 -97.27 135.99 38.4 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.108 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 -149.75 155.47 40.2 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.3 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.3 mt -117.83 120.09 63.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.848 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.9 mt -117.39 132.14 68.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.252 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.67 137.07 38.65 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.092 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -128.85 125.88 38.62 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.044 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.3 p -67.75 139.37 56.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.177 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -88.9 149.67 43.99 Favored Pre-proline 0 C--O 1.234 0.241 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.144 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -74.63 122.34 8.0 Favored 'Cis proline' 0 C--N 1.351 0.669 0 C-N-CA 123.64 -1.4 . . . . 0.0 112.498 0.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.3 p -70.59 125.36 28.72 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.755 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.9 mttp -95.88 130.37 42.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -56.17 -38.41 70.88 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.741 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.86 -44.36 94.18 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.826 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.46 -41.62 88.77 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.252 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.3 t -68.03 -48.99 72.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.971 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.26 -43.08 92.47 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.848 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 -42.18 80.73 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.911 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -48.1 79.19 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.222 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.0 t -62.6 -42.47 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.287 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.5 m -63.93 -39.06 93.3 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.044 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 35.0 m -71.51 -47.15 57.15 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.3 t -58.54 -49.46 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 120.52 0.2 . . . . 0.0 111.506 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -83.6 -24.66 31.38 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.85 26.29 67.35 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.98 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -157.78 155.94 27.62 Favored Pre-proline 0 C--O 1.233 0.189 0 CA-C-N 116.864 0.332 . . . . 0.0 111.173 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.94 95.65 0.91 Allowed 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.657 2.238 . . . . 0.0 112.165 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mp -100.32 148.6 24.5 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.068 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -100.47 139.78 35.66 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.996 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 35.6 mt -87.68 106.3 17.95 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.662 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -100.53 114.93 28.96 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.017 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -93.46 126.9 38.85 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.168 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -128.26 116.83 20.46 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.812 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -77.5 -49.18 15.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.436 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -172.83 -62.93 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.476 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.65 -23.64 11.35 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.771 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.35 141.07 36.57 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.839 0.352 . . . . 0.0 111.581 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.59 128.16 55.54 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.964 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.2 mt -122.16 133.08 69.57 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.758 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.5 tt -95.07 135.32 36.75 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 mt -97.15 108.79 21.59 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.94 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -107.84 -40.94 5.12 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.221 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.1 p-10 -129.93 179.65 5.74 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.474 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -61.63 -30.92 71.02 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.185 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.25 -46.72 72.66 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.057 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -68.61 -37.52 79.83 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.847 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 tp -66.9 -43.7 82.72 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.805 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -66.53 -37.42 84.98 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.154 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -37.01 84.39 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.762 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.37 -43.64 90.15 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.081 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.4 mm -64.12 -43.25 97.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.143 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -53.82 -46.02 71.0 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.859 0.361 . . . . 0.0 110.848 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.6 mt -64.53 -39.43 85.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.966 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tp -65.23 -46.73 79.43 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.188 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -61.27 -36.61 80.49 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.686 0.279 . . . . 0.0 111.061 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.9 mtt-85 -60.39 -33.53 72.61 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.421 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.6 p -80.32 132.97 35.89 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.728 0.299 . . . . 0.0 111.168 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.2 p -76.21 -33.87 59.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.681 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.2 p -97.31 38.13 1.28 Allowed 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.82 142.78 44.6 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.808 0.337 . . . . 0.0 111.508 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.96 73.37 1.48 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.848 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.7 t 60.64 -169.05 0.16 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.488 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.2 mp -111.01 133.4 53.43 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.024 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.4 mtt85 -101.61 107.49 18.76 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.835 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.9 mt -129.47 132.13 66.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.872 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.98 120.58 40.64 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.668 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.8 mt -95.76 124.85 39.97 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.95 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.3 mt -137.41 147.71 45.63 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.006 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.463 0.176 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.074 -179.969 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.517 0.199 . . . . 0.0 110.466 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 24.2 t -70.23 126.55 30.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.608 0.242 . . . . 0.0 110.604 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -86.89 112.75 22.07 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.047 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.9 mt -113.23 136.02 50.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.901 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -97.63 127.79 43.85 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.829 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -108.89 134.74 51.16 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.997 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.24 125.87 50.16 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.263 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -149.2 123.4 9.53 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.556 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 57.99 35.52 25.33 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 120.93 0.395 . . . . 0.0 110.878 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.19 12.76 76.29 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.126 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -100.98 145.77 28.26 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.934 0.367 . . . . 0.0 110.96 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -97.79 142.74 29.18 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.217 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.29 136.91 26.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.188 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.4 mm -115.16 112.38 39.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.865 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 24.3 mm -129.56 125.98 62.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.928 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.74 146.47 26.5 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.307 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -131.26 120.95 23.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.836 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.4 p -68.08 145.41 54.45 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.968 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 mtt85 -87.55 143.17 33.59 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.086 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -77.52 144.32 76.89 Favored 'Cis proline' 0 C--N 1.349 0.602 0 C-N-CA 123.337 -1.526 . . . . 0.0 112.81 0.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.1 p -99.24 130.44 48.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.989 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -102.27 133.19 47.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.805 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -57.88 -38.51 75.89 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.927 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.81 -44.11 97.29 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.994 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.94 -44.29 96.48 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.125 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.9 t -61.29 -48.14 90.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.788 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.19 -43.97 89.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.229 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -57.73 -47.05 83.54 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.988 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.05 -44.7 96.99 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.861 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.487 ' CG1' HD13 ' A' ' 40' ' ' LEU . 38.5 t -61.24 -42.7 94.48 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.914 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.4 m -61.66 -39.5 91.61 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.969 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.6 m -71.58 -47.96 51.4 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.755 -0.202 . . . . 0.0 111.373 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.7 t -61.84 -50.16 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-O 120.62 0.248 . . . . 0.0 111.245 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -78.25 -24.13 47.02 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.649 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.61 19.17 74.13 Favored Glycine 0 CA--C 1.525 0.662 0 C-N-CA 121.07 -0.585 . . . . 0.0 113.166 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -168.4 154.31 6.76 Favored Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 116.867 0.334 . . . . 0.0 110.74 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.78 143.62 46.43 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.584 2.189 . . . . 0.0 112.387 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.487 HD13 ' CG1' ' A' ' 32' ' ' VAL . 1.1 mp -138.07 163.34 31.85 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.072 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.6 125.88 51.16 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 75.2 mt -84.29 113.33 21.05 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.035 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 121.65 44.62 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.193 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -108.31 116.67 32.39 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.365 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.3 mtt -104.3 133.67 48.81 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.984 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -90.8 -51.13 5.52 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.742 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -171.41 -62.47 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.531 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -107.98 -29.15 9.17 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.43 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.21 160.22 16.0 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.914 0.388 . . . . 0.0 111.32 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.44 132.38 56.24 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.901 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.8 mt -113.65 134.38 56.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.83 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.08 126.73 35.26 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.182 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.7 mt -88.16 86.48 7.1 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.648 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -106.0 -33.0 8.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.292 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -117.11 158.61 23.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.726 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -59.9 -35.01 73.95 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.711 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.14 -39.96 70.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.117 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -60.75 -45.51 94.03 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.91 0.386 . . . . 0.0 110.793 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 tp -71.04 -38.31 72.54 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.001 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.61 -43.15 90.5 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.108 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -34.37 77.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.954 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.36 -39.77 94.23 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.299 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.4 mm -66.48 -42.88 90.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.595 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -59.03 -45.36 90.93 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.984 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.5 mt -65.75 -44.44 93.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.026 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.5 tp -63.67 -37.96 89.3 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.173 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -57.47 -38.15 74.05 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.995 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.98 -31.56 69.33 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.036 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.9 t -66.69 138.24 57.27 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.802 0.334 . . . . 0.0 111.355 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.9 m -75.55 -35.15 60.73 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.43 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 53.2 p -96.39 37.41 1.26 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.45 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.94 105.45 0.57 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.776 0.322 . . . . 0.0 110.775 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.46 86.9 2.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.588 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 p 55.33 -173.8 0.05 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.416 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -112.75 130.22 56.14 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -92.99 107.76 19.47 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.916 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.5 mt -129.54 131.18 67.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.763 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.76 118.8 37.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.42 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.95 129.58 54.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.006 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.72 147.39 32.93 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.644 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.464 0.234 0 CA-C-O 121.05 0.452 . . . . 0.0 110.808 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 . . . . . 0 N--CA 1.465 0.312 0 CA-C-O 120.88 0.371 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.6 t -107.37 117.74 53.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.996 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.23 105.15 17.02 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.501 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.5 mt -100.5 116.89 44.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.245 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -109.03 113.73 26.85 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.643 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.444 ' CD2' HD11 ' A' ' 79' ' ' LEU . 24.3 p90 -117.34 146.13 43.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.244 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -128.34 144.46 51.13 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.354 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -143.37 113.05 6.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.491 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 m120 57.6 39.28 27.73 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.233 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.56 -14.09 60.68 Favored Glycine 0 CA--C 1.524 0.616 0 C-N-CA 120.997 -0.62 . . . . 0.0 113.346 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -86.33 103.69 15.15 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 117.066 0.433 . . . . 0.0 110.636 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.98 140.44 29.65 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.273 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.5 mtt85 -134.72 138.59 44.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.99 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mt -117.48 123.38 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.134 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.7 mt -136.18 132.82 49.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.199 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.74 136.25 42.91 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.036 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -124.84 125.56 44.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.792 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -71.5 124.93 25.75 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -73.0 146.39 87.4 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.056 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -74.79 129.19 17.89 Favored 'Cis proline' 0 C--N 1.349 0.568 0 C-N-CA 123.697 -1.376 . . . . 0.0 112.543 -0.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.2 p -96.55 130.58 44.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.249 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -89.56 139.84 30.14 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.029 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -59.22 -44.91 92.28 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.04 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.35 -38.86 78.06 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.954 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -65.23 -44.45 88.22 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.033 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.2 t -68.19 -49.26 68.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.871 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -59.28 -41.67 89.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.176 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -57.73 -41.68 82.32 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.983 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -63.29 -48.07 79.65 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.42 -42.14 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.135 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.4 m -65.44 -39.05 91.61 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.228 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.6 m -71.35 -44.71 64.52 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.895 -0.139 . . . . 0.0 111.337 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.33 -50.02 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.509 0.195 . . . . 0.0 111.214 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -80.17 -26.37 39.33 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.742 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.88 26.75 55.32 Favored Glycine 0 CA--C 1.522 0.475 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.823 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -167.21 156.21 9.3 Favored Pre-proline 0 N--CA 1.462 0.169 0 CA-C-N 116.764 0.282 . . . . 0.0 111.0 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.38 109.39 2.83 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.575 2.183 . . . . 0.0 112.279 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.6 mp -107.84 134.84 50.2 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.926 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -84.91 133.07 34.3 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.736 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -92.31 108.81 20.23 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.873 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -104.9 118.93 37.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.22 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -91.04 128.89 37.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.81 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.8 ptm -128.42 114.5 16.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.801 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -85.36 -54.15 4.77 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.546 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -167.12 -64.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.401 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -109.5 -23.71 11.36 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.748 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 tt -111.91 146.92 36.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 120.86 0.362 . . . . 0.0 111.305 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 m -120.52 132.78 55.35 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.896 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mp -116.19 133.8 61.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.658 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 tt -98.12 126.56 43.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.831 0.348 . . . . 0.0 110.86 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.8 mt -70.89 97.89 1.49 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.109 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.29 -38.13 11.67 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.182 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -152.61 -173.69 4.65 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.32 -30.79 69.74 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.267 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -53.21 -50.39 64.79 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.081 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.36 -43.5 98.68 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.986 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.51 -38.05 89.65 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.845 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -61.39 -43.48 98.79 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.731 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -35.53 81.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.908 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.58 -35.32 80.12 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.249 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.2 mt -64.67 -42.76 95.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.748 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.16 -39.56 63.68 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.031 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 13.8 mt -66.32 -39.46 84.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.847 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.3 tp -62.71 -42.85 99.86 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.986 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -64.02 -34.4 77.91 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.336 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 50.8 ttt85 -75.43 -34.05 60.97 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.098 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.6 t -85.74 129.41 34.84 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.344 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.46 -40.49 29.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.015 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -75.36 -41.78 55.7 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.34 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.49 101.3 0.17 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.799 0.333 . . . . 0.0 111.062 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.13 -37.48 11.57 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.933 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -121.55 175.24 6.31 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.723 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -101.99 129.78 48.36 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.694 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -86.75 108.79 18.85 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.007 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.9 mt -124.81 132.08 71.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.095 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 tp -102.17 122.67 44.62 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.483 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.444 HD11 ' CD2' ' A' ' 8' ' ' PHE . 4.6 mt -96.18 135.98 37.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.085 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.04 135.89 14.54 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.984 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.3 p . . . . . 0 C--O 1.233 0.232 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.98 179.968 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 . . . . . 0 N--CA 1.464 0.267 0 CA-C-O 120.847 0.356 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -144.81 132.7 16.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.036 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.81 111.28 20.6 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.512 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.403 HD12 ' CG ' ' A' ' 19' ' ' PHE . 27.7 mt -107.56 118.4 55.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.934 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -96.59 123.01 40.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.933 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -115.73 127.15 54.91 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -122.13 132.62 54.56 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.829 0.347 . . . . 0.0 111.043 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -146.04 117.2 7.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.652 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.52 33.22 22.09 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.21 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.71 -14.0 62.72 Favored Glycine 0 CA--C 1.525 0.658 0 C-N-CA 120.937 -0.649 . . . . 0.0 113.077 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -88.04 110.72 20.84 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.941 0.37 . . . . 0.0 110.887 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.66 144.3 28.9 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.201 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.1 mtt85 -133.49 149.81 51.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.993 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.7 mp -115.82 112.76 41.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.803 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.5 mp -123.53 136.91 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 120.861 0.362 . . . . 0.0 111.319 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.13 129.5 42.21 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.027 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.403 ' CG ' HD12 ' A' ' 6' ' ' ILE . 21.4 m-85 -124.76 126.39 45.58 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.967 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 p -66.48 135.74 54.68 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.161 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -100.54 146.31 31.81 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.042 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.21 123.49 9.42 Favored 'Cis proline' 0 C--N 1.35 0.655 0 C-N-CA 123.335 -1.527 . . . . 0.0 112.499 -0.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.54 130.03 36.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.975 0.417 . . . . 0.0 111.254 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.54 146.39 24.62 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.044 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -56.98 -37.27 71.38 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.083 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -61.32 -43.72 98.4 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.919 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.76 -39.18 87.77 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.142 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.7 t -67.96 -48.85 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.872 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.7 -44.68 90.38 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.926 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -59.99 -37.03 78.48 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.126 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.94 -48.06 55.59 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.857 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.2 t -65.5 -45.75 91.81 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.431 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 t -61.0 -38.93 87.78 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.708 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.6 m -71.24 -43.78 66.62 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.2 t -64.89 -50.53 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 120.576 0.227 . . . . 0.0 111.419 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -83.72 -13.34 54.23 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.26 24.03 71.86 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.88 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -153.15 147.31 18.75 Favored Pre-proline 0 CA--C 1.529 0.172 0 CA-C-N 116.752 0.276 . . . . 0.0 110.961 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.24 71.73 5.05 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.559 2.173 . . . . 0.0 112.124 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.4 mp -76.92 131.55 38.61 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.847 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -76.98 140.09 40.3 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.991 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 33.5 mt -82.18 118.58 23.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.897 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -116.94 119.6 35.83 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.995 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -90.63 117.27 29.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.82 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.7 115.65 22.44 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.827 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -86.53 -72.21 0.51 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.053 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -134.9 -67.43 0.56 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.608 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -122.78 18.56 10.26 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.207 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.0 tp -131.68 138.22 48.62 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.604 0.24 . . . . 0.0 110.979 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.97 122.52 39.54 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.765 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.8 mp -114.44 131.14 67.36 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.684 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.2 tt -92.13 127.88 37.77 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.874 0.369 . . . . 0.0 111.116 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.8 mp -92.95 90.06 6.8 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.789 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.88 -31.82 15.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.145 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -132.08 174.49 10.14 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.989 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.59 -32.05 72.98 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.294 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -54.28 -42.2 69.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.71 0.29 . . . . 0.0 110.94 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.64 -46.19 83.59 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.162 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.3 tp -61.77 -41.92 98.32 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.599 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -61.52 -41.77 97.81 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.734 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.87 -39.49 94.33 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.835 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.81 -38.42 90.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.333 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.5 mt -64.37 -44.04 97.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.599 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -56.0 -42.4 76.35 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.052 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.1 mt -66.12 -45.57 90.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.112 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tp -58.9 -43.47 91.04 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.803 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -69.29 -36.77 77.38 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.036 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -26.64 68.8 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.27 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.2 t -62.36 164.72 6.83 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.912 0.386 . . . . 0.0 111.382 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 p -64.06 -40.72 96.89 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.185 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.5 p -163.93 -63.92 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.232 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 63.16 -177.58 0.15 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.135 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -152.61 115.41 4.57 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.789 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.06 -172.2 0.17 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.954 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.2 mp -125.39 125.85 44.06 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.721 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -86.2 107.07 17.73 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.914 0.387 . . . . 0.0 110.606 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 8.2 mt -127.85 131.53 69.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.723 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -101.93 128.95 48.11 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.538 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.4 mt -94.15 133.65 37.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.023 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.7 mt -135.37 143.78 46.25 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.146 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t . . . . . 0 C--O 1.233 0.213 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.899 179.87 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 . . . . . 0 N--CA 1.465 0.298 0 CA-C-O 120.653 0.263 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -138.75 141.43 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.245 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -95.01 105.5 17.42 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.916 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.413 ' CD1' ' HB2' ' A' ' 19' ' ' PHE . 2.7 mt -111.72 116.96 53.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.882 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -96.1 118.31 32.43 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.75 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -96.83 129.17 44.3 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.019 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -119.09 128.68 54.55 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.875 0.369 . . . . 0.0 111.691 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -142.2 120.1 11.99 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.525 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 44.1 t30 54.96 38.28 30.21 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.793 0.33 . . . . 0.0 111.072 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 84.52 -14.51 46.09 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 121.168 -0.539 . . . . 0.0 113.588 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -87.32 121.02 29.22 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 117.22 0.51 . . . . 0.0 110.855 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -100.33 154.45 18.48 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.369 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.9 mtt-85 -140.04 139.97 36.07 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.913 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.9 mt -108.75 114.79 47.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.225 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.8 mt -139.88 136.06 38.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.235 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.69 133.57 41.06 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.303 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.413 ' HB2' ' CD1' ' A' ' 6' ' ' ILE . 21.5 m-85 -121.86 129.36 52.53 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.89 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.24 157.87 25.03 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.869 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.0 mtm105 -109.51 153.98 42.56 Favored Pre-proline 0 C--O 1.234 0.253 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.113 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -75.74 131.79 25.4 Favored 'Cis proline' 0 C--N 1.349 0.593 0 C-N-CA 123.189 -1.588 . . . . 0.0 112.756 0.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.9 p -105.6 125.73 60.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.871 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -87.04 137.46 32.33 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.727 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.404 ' CE1' HD12 ' A' ' 42' ' ' LEU . 65.5 t80 -55.68 -38.72 70.01 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.754 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.06 -43.49 95.39 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.165 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -62.63 -43.8 97.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.166 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.8 t -69.09 -45.15 80.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.457 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -61.81 -38.4 87.96 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.358 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.87 -47.46 82.65 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.807 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.2 mtpp -61.4 -46.59 89.52 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.894 179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.2 t -57.47 -48.17 83.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.919 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.7 m -62.33 -39.37 92.87 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.37 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.1 m -71.71 -46.26 59.23 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -61.44 -50.16 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.514 0.197 . . . . 0.0 111.488 -179.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.423 ' CD2' HD12 ' A' ' 40' ' ' LEU . 72.9 m-85 -83.4 -21.46 33.01 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.41 30.35 64.75 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.812 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -168.2 151.87 5.78 Favored Pre-proline 0 N--CA 1.463 0.2 0 CA-C-N 116.59 0.195 . . . . 0.0 111.081 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -75.17 107.38 2.47 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.573 2.182 . . . . 0.0 112.236 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.423 HD12 ' CD2' ' A' ' 36' ' ' PHE . 3.4 mp -105.44 143.16 33.99 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.298 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -88.62 129.46 35.5 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.781 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.404 HD12 ' CE1' ' A' ' 25' ' ' TYR . 50.7 mt -86.12 103.01 14.37 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.904 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -93.08 120.92 33.89 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.101 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -96.86 125.38 41.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.994 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.2 ptp -126.65 114.23 17.76 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.035 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -86.94 -54.3 4.42 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.801 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -157.13 -65.81 0.1 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.506 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -126.2 13.23 7.74 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.533 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.6 tp -131.62 132.96 44.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.628 0.251 . . . . 0.0 110.961 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 m -110.51 126.07 53.99 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.963 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.0 mt -114.63 134.12 58.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.89 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 tt -92.08 122.3 34.45 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.81 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 mt -80.39 87.26 5.65 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.058 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.98 -31.75 14.78 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.382 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -142.85 -179.63 6.46 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.891 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -62.68 -31.35 72.23 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.14 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.24 -43.81 67.62 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.1 0.25 . . . . 0.0 111.099 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.25 -40.05 89.94 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.188 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.5 tp -69.3 -41.38 76.84 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.763 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -65.89 -40.21 91.34 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.341 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.8 tptt -62.67 -36.94 84.5 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.396 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.31 90.69 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.343 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 54.0 mt -62.75 -42.52 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.005 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.25 -45.54 72.39 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.119 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 4.9 mt -69.37 -41.92 81.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.906 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.7 tp -61.39 -44.52 97.01 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.029 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -61.47 -39.26 90.24 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.045 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 7.8 mtm-85 -62.65 -34.3 76.79 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.243 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.0 t -87.01 119.98 27.78 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.806 0.336 . . . . 0.0 111.212 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 71.9 m -78.19 -32.47 50.08 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.253 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.6 p -93.47 35.7 1.1 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.699 0.285 . . . . 0.0 111.612 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.8 ttp -147.41 80.96 1.52 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.821 0.343 . . . . 0.0 110.816 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -103.18 31.44 4.27 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.335 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.5 m -156.52 142.52 18.03 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.65 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -116.46 131.94 56.81 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 111.189 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -99.72 118.15 35.61 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.048 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 mp -125.22 132.39 71.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.759 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 mt -101.94 119.42 38.77 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.679 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -93.39 119.95 33.1 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.998 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 pp -130.9 136.54 48.69 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.978 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 54.7 p . . . . . 0 C--N 1.331 -0.211 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.788 179.716 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.728 0.299 . . . . 0.0 110.424 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -78.21 135.82 25.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.857 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.95 107.25 18.3 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.857 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.3 mt -110.01 120.6 61.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.977 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.09 119.2 38.4 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.669 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.445 ' HB3' HD12 ' A' ' 79' ' ' LEU . 49.7 m-85 -100.74 127.2 47.26 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.481 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -118.82 131.2 56.08 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.874 0.369 . . . . 0.0 111.37 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -141.74 120.62 12.75 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.513 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 m120 56.13 34.99 24.9 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.511 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.13 -14.19 61.37 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 120.915 -0.659 . . . . 0.0 113.159 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -89.43 116.93 27.98 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 117.055 0.428 . . . . 0.0 110.429 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.14 144.16 39.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.394 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.1 mtt-85 -133.98 139.41 46.06 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.9 mp -102.27 118.59 49.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.235 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -137.04 129.96 44.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.974 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.31 142.87 27.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.118 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -133.84 118.08 17.57 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.941 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.5 t -64.62 130.47 43.75 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.977 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -74.46 160.02 82.18 Favored Pre-proline 0 CA--C 1.53 0.195 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.346 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.86 130.17 19.9 Favored 'Cis proline' 0 C--N 1.35 0.609 0 C-N-CA 123.219 -1.576 . . . . 0.0 112.558 -0.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -71.61 125.18 29.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.021 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.17 137.94 39.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.928 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -55.91 -45.03 78.79 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.735 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -39.69 94.44 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.03 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.12 -44.41 95.71 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.105 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 42.6 t -67.97 -48.42 74.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.881 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -39.24 93.48 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.111 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -58.0 -39.4 78.17 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.933 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -69.23 -47.49 64.59 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.062 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.6 t -68.24 -43.6 84.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.477 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.7 m -60.38 -38.66 84.6 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.102 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.4 m -71.49 -43.79 65.91 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 111.464 0.172 . . . . 0.0 111.464 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.1 t -63.34 -50.86 77.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 120.535 0.207 . . . . 0.0 111.42 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -83.48 -18.68 37.7 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.21 21.06 75.55 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 121.067 -0.587 . . . . 0.0 113.052 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -149.71 151.64 33.23 Favored Pre-proline 0 CA--C 1.53 0.178 0 CA-C-N 116.94 0.37 . . . . 0.0 110.933 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -75.32 95.0 0.97 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.634 2.223 . . . . 0.0 112.122 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.8 mp -93.52 145.32 24.6 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.232 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -91.96 130.92 37.61 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.733 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mp -90.2 103.08 15.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.946 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -94.71 120.08 34.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.197 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -99.08 120.54 39.64 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.537 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.02 129.67 56.17 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.671 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -90.46 -50.67 5.82 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.735 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -171.99 -63.63 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.454 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -109.19 -26.69 9.97 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.397 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.27 138.99 40.6 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.754 0.312 . . . . 0.0 111.279 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.2 t -110.31 129.64 55.7 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.888 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.7 mt -120.01 134.09 64.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.811 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.3 tt -99.32 135.1 41.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.676 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.3 mt -73.85 86.48 1.74 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.024 0.44 . . . . 0.0 111.096 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.5 tptp -80.55 -36.63 32.76 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.234 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -152.33 178.54 9.42 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.247 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -58.3 -33.0 68.98 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.09 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.63 -43.47 72.3 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.699 0.285 . . . . 0.0 110.86 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -67.35 -40.44 85.85 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.676 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 9.3 tp -64.49 -44.6 90.45 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.153 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.3 -38.63 91.9 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.139 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.9 mttt -62.99 -41.93 99.7 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.494 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.82 -45.39 92.83 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.183 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.2 mm -65.04 -44.92 95.81 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.134 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.085 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.7 -45.54 85.56 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.379 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.9 mt -70.06 -45.16 77.27 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.969 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.2 tp -63.72 -46.4 85.56 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.375 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.78 -40.78 84.99 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.807 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -68.3 -33.59 74.6 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.101 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.6 t -82.31 113.91 20.43 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.923 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 m -75.25 -29.2 60.14 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.997 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.61 -35.26 65.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.184 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 mmm -108.46 154.85 21.31 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.102 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.6 mmtm -134.77 -52.14 0.8 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.709 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 p -79.0 169.73 17.76 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.034 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.58 121.65 45.71 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.044 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.48 108.19 19.5 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.821 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.8 mt -128.94 132.2 67.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 tp -102.12 119.48 38.88 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.509 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.445 HD12 ' HB3' ' A' ' 8' ' ' PHE . 2.8 mt -93.54 131.64 38.6 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.955 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.0 mp -142.12 138.45 31.66 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.792 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.463 0.185 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.371 -179.797 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 . . . . . 0 N--CA 1.468 0.455 0 CA-C-O 120.764 0.316 . . . . 0.0 111.508 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.9 t -93.05 130.76 41.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.949 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -87.21 113.94 23.38 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.761 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 mm -106.69 123.98 61.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.21 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.66 111.8 23.79 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.752 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.42 ' CE2' ' HB2' ' A' ' 15' ' ' ARG . 11.2 p90 -116.41 149.14 39.91 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.305 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -118.01 139.85 50.6 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.086 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -146.03 114.54 6.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.436 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 t30 58.72 35.01 24.17 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.135 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.72 12.47 81.48 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.071 -0.585 . . . . 0.0 113.177 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -111.29 122.07 46.9 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 117.059 0.43 . . . . 0.0 110.736 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -93.32 139.72 30.34 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.147 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.42 ' HB2' ' CE2' ' A' ' 8' ' ' PHE . 16.0 mmt180 -139.04 136.7 35.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.161 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 mp -117.01 129.63 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.221 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 32.7 mt -140.92 129.62 24.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.131 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.6 134.61 34.27 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.031 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -129.2 121.48 27.76 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.045 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p -66.39 136.49 55.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.898 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -77.41 147.22 75.31 Favored Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.993 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.83 133.84 31.9 Favored 'Cis proline' 0 C--N 1.35 0.633 0 C-N-CA 123.347 -1.522 . . . . 0.0 112.625 0.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.7 p -81.46 123.45 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.091 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -102.66 143.76 31.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.01 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -60.27 -42.1 94.71 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.6 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.405 ' HG2' ' CD2' ' A' ' 30' ' ' HIS . 12.2 tt0 -57.89 -41.6 82.88 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.098 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -62.48 -44.45 96.37 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.087 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 37.3 t -70.99 -48.44 55.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.893 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -40.54 85.01 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.392 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . 0.405 ' CD2' ' HG2' ' A' ' 26' ' ' GLU . 4.5 m-70 -57.9 -46.67 84.59 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.697 0.284 . . . . 0.0 111.06 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -48.26 50.92 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.094 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.4 t -56.99 -46.29 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.374 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 91.4 m -61.2 -38.85 88.06 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.952 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.1 m -71.3 -42.27 68.88 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 111.481 0.178 . . . . 0.0 111.481 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 41.5 t -60.2 -49.97 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-O 120.607 0.241 . . . . 0.0 111.068 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -83.61 -25.79 30.55 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.883 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.35 14.0 62.7 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.03 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -154.39 152.16 25.6 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.977 0.389 . . . . 0.0 110.872 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -72.46 79.74 1.78 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.641 2.227 . . . . 0.0 112.29 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.7 mp -75.31 140.03 42.85 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.878 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.0 136.81 32.79 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.02 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.9 mt -86.19 118.69 25.8 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.91 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.1 m170 -109.07 119.58 39.96 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.063 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.412 ' CB ' HD11 ' A' ' 53' ' ' LEU . 13.0 t80 -120.22 128.35 53.28 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.796 0.331 . . . . 0.0 110.672 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.5 mtm -110.49 118.52 36.47 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.377 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -60.8 -67.5 0.39 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.876 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.88 -59.79 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.37 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -120.96 11.6 11.05 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.604 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -131.22 159.2 38.47 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.689 0.281 . . . . 0.0 111.019 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.4 p -118.1 118.53 32.14 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.05 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.7 mt -113.67 133.9 58.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.858 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.3 tt -96.44 123.29 40.04 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.945 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.412 HD11 ' CB ' ' A' ' 44' ' ' TYR . 7.3 mt -92.34 81.0 4.93 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.864 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.2 tttp -103.5 -32.82 9.29 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.972 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -107.9 165.57 11.36 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.8 0.333 . . . . 0.0 111.102 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.52 -35.85 80.72 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.952 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.47 -42.65 74.63 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.025 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -60.1 -44.48 94.79 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.661 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.9 tt -66.28 -40.69 90.27 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.074 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.11 -41.45 96.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.904 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -66.32 -37.27 84.99 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.061 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.17 -45.42 91.89 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.348 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 42.3 mm -66.11 -41.04 88.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.775 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -55.33 -41.17 72.1 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.085 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 7.6 mt -66.81 -41.43 87.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.922 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.5 tp -62.76 -41.98 99.47 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.007 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -58.62 -38.01 77.13 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.209 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -31.75 64.99 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.298 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.9 t -98.9 93.09 5.84 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.219 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 89.2 p -67.88 -31.31 71.02 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.388 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.2 p -56.43 -43.67 79.65 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.182 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 6.2 ttp -83.47 157.39 22.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.223 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.4 mttm -143.73 -51.28 0.32 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.93 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.9 m -79.6 149.74 31.26 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.076 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -113.9 126.48 55.22 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.898 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.5 mtt-85 -93.02 109.91 21.37 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.944 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 38.6 mt -128.93 132.2 67.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.094 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.7 mp -102.21 132.03 48.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.673 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.7 mt -94.15 132.34 38.78 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.09 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 89.1 mt -143.63 137.31 28.21 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.905 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 p . . . . . 0 C--O 1.233 0.196 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.131 -179.813 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 . . . . . 0 C--O 1.234 0.25 0 CA-C-O 121.014 0.435 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -85.72 135.88 24.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.173 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -95.84 106.16 18.26 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.888 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 33.3 mt -101.09 126.38 54.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.018 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -98.83 116.37 30.91 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.913 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -93.38 145.63 24.34 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.247 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.32 132.76 50.2 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.348 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -146.14 113.85 6.42 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.626 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 58.3 33.74 23.42 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.12 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.96 -13.64 62.56 Favored Glycine 0 CA--C 1.526 0.719 0 C-N-CA 120.917 -0.659 . . . . 0.0 113.048 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -77.05 152.58 35.03 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 117.007 0.404 . . . . 0.0 110.949 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -115.54 144.7 43.49 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.4 144.85 46.78 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.925 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.4 mt -115.51 120.28 64.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.18 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 31.3 mt -141.62 126.58 17.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.238 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.51 135.24 33.99 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.162 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -127.02 128.37 46.23 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.051 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.9 p -87.1 123.06 31.75 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.669 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -64.91 154.08 86.96 Favored Pre-proline 0 C--O 1.233 0.232 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.264 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.39 127.34 14.79 Favored 'Cis proline' 0 C--N 1.35 0.616 0 C-N-CA 123.343 -1.524 . . . . 0.0 112.733 0.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.9 p -84.26 122.83 38.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.887 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.55 142.69 29.83 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.079 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -60.39 -42.41 95.84 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.987 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.412 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 16.2 mt-10 -61.56 -39.41 91.01 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.954 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -68.75 -44.28 74.07 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.015 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 29.1 t -62.22 -48.02 90.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.838 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.412 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 10.8 pt-20 -63.78 -34.79 78.68 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.261 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.2 -48.38 80.51 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.047 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -63.48 -40.59 97.5 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.743 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.97 -44.19 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.314 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 m -65.23 -38.88 91.75 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.965 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 m -71.55 -47.35 55.65 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.5 p -59.92 -48.8 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -84.01 -18.11 38.22 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.47 28.47 69.53 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.711 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -162.49 156.32 17.88 Favored Pre-proline 0 CA--C 1.529 0.158 0 CA-C-N 116.725 0.263 . . . . 0.0 110.922 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.04 107.12 2.29 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.664 2.243 . . . . 0.0 112.526 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.407 ' CD2' ' HB3' ' A' ' 79' ' ' LEU . 6.1 mp -108.65 126.44 52.98 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.029 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.44 135.4 39.41 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.842 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.5 mt -83.18 95.59 8.16 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.932 0.396 . . . . 0.0 110.536 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 -87.56 118.01 26.75 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.188 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -107.52 118.63 37.23 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.447 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.4 mmm -117.61 131.65 56.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.06 -48.74 7.83 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.586 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -173.15 -62.66 0.02 OUTLIER 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.482 179.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -111.29 -25.29 9.75 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.81 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -101.38 132.22 47.07 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 111.261 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -97.81 127.62 43.88 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.988 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.0 mt -118.11 131.51 70.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.011 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.4 tt -101.31 121.74 42.44 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.807 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 43.9 mt -79.14 100.64 7.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.65 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.52 -34.99 11.84 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.118 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -141.61 178.52 7.41 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.901 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -32.79 73.65 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.268 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.1 -47.68 71.52 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.648 0.261 . . . . 0.0 111.145 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -65.59 -46.2 80.31 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.0 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.3 tp -62.71 -42.46 99.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.146 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.24 -36.38 81.53 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.066 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.86 -36.48 83.4 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.651 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.22 -36.42 84.1 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.113 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 25.8 mm -64.56 -46.07 93.68 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.903 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.81 -40.25 69.34 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.267 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 11.7 mt -68.35 -45.63 82.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.893 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.3 tp -66.6 -42.62 86.61 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.027 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.85 -42.65 84.9 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.111 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -69.81 -30.4 67.92 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.925 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.5 t -69.2 146.69 52.18 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.817 0.342 . . . . 0.0 111.147 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.4 m -75.84 -20.83 57.82 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.617 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 76.1 p -94.43 38.69 1.09 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.792 0.329 . . . . 0.0 111.426 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.38 120.64 24.09 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.594 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.35 -68.18 0.19 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.963 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.31 173.19 8.54 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.872 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.3 mp -109.24 125.76 52.6 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.12 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 26.9 ttt180 -86.7 107.33 18.17 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.708 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.9 mt -129.7 131.89 66.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.963 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.4 mt -102.03 127.64 48.82 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.817 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 40' ' ' LEU . 40.0 mt -93.74 119.67 33.02 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.101 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mp -144.95 144.89 31.3 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.917 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.234 0.26 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.82 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.467 0.386 0 CA-C-O 120.746 0.308 . . . . 0.0 111.071 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.3 t -108.74 139.82 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.205 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.61 113.31 25.38 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.225 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.416 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 24.0 mt -110.14 123.93 66.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.823 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.0 mttm -95.92 119.94 35.32 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.663 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -106.58 141.26 38.16 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.098 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -120.82 125.75 48.35 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.126 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -140.65 116.75 10.53 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.603 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 57.65 32.92 22.57 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.142 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.77 -14.25 60.63 Favored Glycine 0 CA--C 1.525 0.711 0 C-N-CA 120.876 -0.678 . . . . 0.0 113.137 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.76 129.02 34.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.963 0.382 . . . . 0.0 110.859 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.61 135.01 45.02 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.949 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -139.51 143.95 37.7 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.8 mp -116.37 121.25 67.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.94 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.2 mm -123.4 136.35 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.347 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -100.22 134.12 43.62 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.011 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -128.0 125.87 40.25 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.091 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.2 t -85.56 150.97 24.28 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.97 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -86.62 150.78 51.77 Favored Pre-proline 0 CA--C 1.529 0.173 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.428 179.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.09 127.22 14.61 Favored 'Cis proline' 0 C--N 1.349 0.582 0 C-N-CA 123.573 -1.428 . . . . 0.0 112.752 0.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.5 p -93.07 129.88 42.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.057 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.59 143.63 30.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.104 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -57.36 -52.58 64.79 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.872 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.03 -35.27 74.73 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.036 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -62.39 -44.77 95.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.719 0.295 . . . . 0.0 110.987 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.6 t -67.69 -48.43 76.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.52 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -62.75 -36.84 84.36 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.46 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -57.69 -45.03 86.18 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.026 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -46.48 90.41 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.776 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 33.8 t -61.65 -47.45 93.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.208 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 m -65.69 -38.74 90.09 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.388 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.0 m -71.5 -48.48 48.7 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 111.55 0.204 . . . . 0.0 111.55 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.39 -50.06 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.474 0.178 . . . . 0.0 111.36 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -80.74 -20.13 43.43 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.47 34.41 73.85 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.802 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.434 ' OE1' ' HB3' ' A' ' 81' ' ' SER . 1.1 pt20 -167.6 149.65 5.33 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.73 0.265 . . . . 0.0 111.238 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.65 126.84 8.44 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.76 2.307 . . . . 0.0 112.709 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.4 mp -133.79 144.51 49.07 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.919 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.34 130.17 37.23 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.636 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.403 ' HB2' ' HB2' ' A' ' 53' ' ' LEU . 1.1 mp -81.6 116.74 21.5 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.083 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -102.03 121.26 41.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.186 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.502 ' CZ ' ' HB1' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -94.62 128.78 41.5 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.794 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.2 ptt? -131.59 114.56 14.99 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.742 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -90.57 -66.01 0.96 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.718 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -146.04 -70.42 0.26 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.409 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -112.46 -16.0 12.98 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.62 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -110.7 139.78 45.67 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.802 0.334 . . . . 0.0 111.253 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.1 m -120.77 124.68 45.71 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.598 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.9 mt -114.96 134.44 58.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.024 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 tt -92.0 129.37 37.97 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.185 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.403 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 8.2 mt -82.36 90.44 6.68 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.058 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -106.74 -33.67 7.53 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.158 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.05 167.08 11.47 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.062 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.36 -37.07 85.92 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.061 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -55.47 -37.59 67.97 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.238 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -65.52 -41.74 92.78 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.672 0.273 . . . . 0.0 110.819 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.79 -42.29 86.21 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.979 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -68.79 -41.64 78.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.009 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -36.49 81.9 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.818 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.502 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -64.83 -40.43 95.18 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.369 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.0 mt -65.06 -41.44 91.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.035 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -53.41 -44.42 68.73 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.173 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 37.5 mt -68.85 -44.2 81.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.05 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.48 -43.41 97.38 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.925 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -60.51 -40.45 91.46 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.36 -32.84 73.21 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.16 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.3 t -89.33 107.63 19.17 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.291 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 12.9 t -70.64 -29.03 65.28 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.672 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 p -60.71 -61.72 2.38 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.0 ttt -76.32 115.76 16.37 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.767 0.318 . . . . 0.0 111.248 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.8 mttm -93.11 -37.02 12.36 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.426 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.7 m -110.72 166.17 11.23 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.625 0.25 . . . . 0.0 111.108 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.416 ' HG ' ' HA ' ' A' ' 6' ' ' ILE . 0.3 OUTLIER -116.86 136.7 52.75 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.107 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.5 mtp85 -86.32 116.59 24.58 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.158 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.2 mm -126.65 129.84 71.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.227 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.3 mp -102.15 125.67 48.9 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.607 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.0 mt -98.08 129.44 44.91 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.089 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -149.62 135.41 18.65 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.253 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' SER . . . . . 0.434 ' HB3' ' OE1' ' A' ' 38' ' ' GLN . 81.6 p . . . . . 0 C--O 1.234 0.251 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.456 179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 t70 . . . . . 0 C--O 1.232 0.183 0 CA-C-O 120.805 0.336 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -98.93 131.66 45.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.034 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -90.16 105.56 17.89 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.893 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -111.15 135.13 51.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.056 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -104.25 121.23 42.87 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.698 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 0.427 ' O ' ' HA ' ' A' ' 14' ' ' ARG . 11.3 m-85 -99.85 142.24 31.59 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.084 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -131.69 125.54 32.33 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -148.86 117.67 6.66 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.686 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 58.0 31.47 20.68 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.456 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.87 -14.44 58.62 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.087 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -85.08 106.98 16.95 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 117.013 0.406 . . . . 0.0 110.378 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.427 ' HA ' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -101.21 144.07 30.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.013 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -143.01 157.94 44.07 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.364 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.8 mp -115.98 123.07 70.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.821 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 30.9 mt -130.86 138.63 53.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.181 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.24 133.97 34.59 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.125 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -128.13 117.63 21.96 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 97.6 p -76.21 145.89 39.46 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.126 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -98.91 154.52 37.32 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.032 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.34 120.71 7.14 Favored 'Cis proline' 0 C--N 1.351 0.704 0 C-N-CA 123.335 -1.527 . . . . 0.0 112.796 0.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -75.57 129.46 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.266 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.73 139.29 33.82 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.973 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -55.31 -44.25 75.62 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.765 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.71 -41.15 94.66 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.924 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.4 -44.44 96.43 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.116 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.2 t -65.88 -48.63 81.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.823 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -58.44 -39.97 81.3 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.241 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -40.24 80.25 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.754 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.54 -48.13 65.11 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.993 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 23.2 t -60.02 -42.62 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.344 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.6 m -61.37 -39.0 89.04 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.924 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.9 m -71.49 -46.98 58.34 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 111.47 0.174 . . . . 0.0 111.47 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 36.8 t -58.27 -50.05 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -83.6 -24.67 31.39 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.17 28.25 58.59 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.848 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.418 ' HB2' ' HD2' ' A' ' 39' ' ' PRO . 1.5 pt20 -173.08 159.63 3.49 Favored Pre-proline 0 N--CA 1.464 0.226 0 CA-C-N 116.712 0.256 . . . . 0.0 110.973 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.418 ' HD2' ' HB2' ' A' ' 38' ' ' GLN . 56.3 Cg_endo -71.23 109.73 2.66 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.631 2.221 . . . . 0.0 112.524 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.9 mp -115.59 154.82 28.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.091 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -98.17 141.9 30.52 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.779 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.49 100.06 9.38 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.695 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.0 m170 -92.14 131.04 37.7 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.418 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -107.03 121.94 45.46 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.486 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 7.7 mmt -109.32 114.75 28.69 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.62 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -72.3 -56.58 5.26 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.734 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -170.77 -58.6 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.574 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -117.44 2.57 12.45 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.676 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.76 159.59 38.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.784 0.326 . . . . 0.0 111.659 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.87 125.08 49.84 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.262 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.0 mm -116.14 132.11 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.851 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -96.33 126.82 41.8 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.817 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.0 mt -87.56 92.11 8.98 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.761 0.315 . . . . 0.0 110.764 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.9 pttt -107.46 -34.38 7.07 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.416 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -131.54 171.04 13.9 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.712 0.291 . . . . 0.0 111.033 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -31.54 71.19 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.922 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -54.09 -44.77 71.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.664 0.269 . . . . 0.0 111.029 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -67.21 -36.76 82.4 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.809 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.3 tp -68.86 -41.85 77.87 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.095 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.58 -41.1 96.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.066 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -62.99 -39.21 94.07 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.847 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.3 -43.67 97.17 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.078 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 43.9 mm -65.37 -41.49 91.34 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.826 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.48 -43.26 75.38 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.971 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.0 mt -67.83 -42.44 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.881 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.9 tp -67.36 -39.23 85.69 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.399 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.57 -37.51 86.45 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.695 0.283 . . . . 0.0 110.924 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -32.37 62.78 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.511 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.3 p -78.48 119.45 21.8 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.03 0.443 . . . . 0.0 111.162 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.49 -29.5 56.85 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.674 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.1 p -93.67 34.58 1.18 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 120.634 0.254 . . . . 0.0 111.678 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.5 mtm -149.98 123.21 8.93 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.667 0.27 . . . . 0.0 111.022 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.55 -46.97 2.35 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.684 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.1 t -83.65 174.09 10.81 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.951 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mp -119.07 135.29 54.72 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.903 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.9 mtt85 -102.0 107.49 18.63 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.727 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 9.0 mt -129.58 131.79 66.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.868 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.07 119.48 38.86 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.604 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.6 mt -93.42 129.44 39.57 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.116 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mp -138.58 134.95 34.47 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.086 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.466 0.344 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.96 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.466 0.333 0 CA-C-O 120.817 0.341 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -75.46 143.68 12.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.075 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.4 mtp85 -95.36 114.65 26.44 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.769 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 mp -115.4 134.74 57.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.269 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.69 127.47 47.09 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.785 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -107.46 138.46 43.63 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.059 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -130.47 124.18 31.41 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.105 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.423 ' CD2' ' HB2' ' A' ' 79' ' ' LEU . 1.9 t-160 -147.06 127.91 14.42 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.633 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.08 27.68 16.71 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.489 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.45 -13.98 60.78 Favored Glycine 0 CA--C 1.526 0.728 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.13 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -83.04 163.44 20.96 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 117.004 0.402 . . . . 0.0 111.119 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.1 mtt180 -120.65 153.03 37.42 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.251 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.1 141.15 28.55 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.02 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mt -111.73 119.02 59.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.877 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.16 130.34 34.24 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 120.925 0.393 . . . . 0.0 111.218 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.57 135.68 40.62 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.055 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -122.93 126.65 47.65 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.11 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.3 m -72.63 138.56 46.81 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.015 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.26 152.68 38.71 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.964 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.2 132.31 26.89 Favored 'Cis proline' 0 C--N 1.349 0.594 0 C-N-CA 123.275 -1.552 . . . . 0.0 112.726 0.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -110.65 130.45 63.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.118 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.71 144.91 25.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.014 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -54.71 -37.4 65.81 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.193 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -59.35 -45.07 92.41 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.046 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.47 -44.21 95.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.105 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.4 t -65.43 -48.82 81.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.891 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -56.68 -41.42 77.29 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.839 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -57.67 -42.32 83.33 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.737 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.8 -47.64 71.47 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.131 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.53 -45.65 86.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.138 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.9 m -62.66 -38.78 91.67 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.087 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.3 m -71.48 -46.91 58.59 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.3 t -60.68 -49.92 82.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -83.84 -21.96 31.87 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.54 -16.74 60.09 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 120.735 -0.745 . . . . 0.0 113.06 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -146.11 158.0 49.0 Favored Pre-proline 0 CA--C 1.531 0.227 0 CA-C-N 116.846 0.323 . . . . 0.0 110.758 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.99 129.61 14.46 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.573 2.182 . . . . 0.0 112.489 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.7 mp -120.86 151.91 39.06 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.36 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.24 137.64 32.17 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.611 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.429 ' HB2' ' HB2' ' A' ' 53' ' ' LEU . 3.1 mt -98.76 107.03 19.37 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.942 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -93.75 114.89 27.27 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.048 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -95.12 129.07 42.36 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 21.8 ptm -127.11 121.63 31.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.712 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -86.34 -60.05 2.11 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.358 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -154.12 -67.97 0.14 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.273 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.59 -21.39 12.15 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.683 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mp -104.65 140.38 38.12 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.768 0.318 . . . . 0.0 111.311 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.91 122.36 46.75 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.827 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.5 mt -113.95 132.52 62.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.83 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 31.2 tp -93.3 134.84 35.1 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.759 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.429 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 56.1 mt -87.37 107.57 18.59 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.997 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.57 -35.72 6.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.306 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -136.87 180.0 6.04 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.39 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -64.32 -34.33 77.88 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.122 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.04 -40.35 73.36 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.796 -0.183 . . . . 0.0 111.283 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -66.36 -50.02 64.96 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.422 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 pp -69.79 -34.38 73.65 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.968 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -61.31 -43.76 98.33 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.62 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -70.22 -32.75 70.77 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.07 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.81 -39.32 93.94 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.319 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 5.8 mt -61.08 -47.37 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.736 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -53.18 -37.32 61.81 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.157 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.0 mt -64.91 -38.38 82.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.067 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.5 mt -66.55 -46.99 74.26 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.984 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.12 -38.16 85.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.199 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -28.74 67.91 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.47 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.1 p -62.44 165.83 5.74 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.956 0.407 . . . . 0.0 111.519 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.88 -43.16 18.56 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.198 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 57.6 p -127.62 -35.06 2.16 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -50.45 91.45 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -106.73 -32.35 8.02 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.168 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.6 p -69.12 -179.85 1.68 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.63 0.252 . . . . 0.0 111.09 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mp -129.69 117.64 20.65 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.723 0.297 . . . . 0.0 111.525 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -86.89 106.89 18.08 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.246 179.356 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.6 mt -129.78 130.8 66.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.111 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -103.9 129.61 51.44 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.578 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.423 ' HB2' ' CD2' ' A' ' 10' ' ' HIS . 4.9 mt -93.63 129.11 40.02 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.25 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.8 mp -138.3 134.08 33.86 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.072 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.7 m . . . . . 0 N--CA 1.463 0.219 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.297 -179.79 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.771 0.319 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.28 138.99 52.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.148 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.61 113.73 25.22 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.031 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 21.3 mt -104.93 117.44 50.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.974 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -98.41 127.16 44.22 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.022 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -110.71 147.87 33.48 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.025 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -129.56 132.76 46.91 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.223 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . 0.414 ' HB2' HD12 ' A' ' 79' ' ' LEU . 12.3 t-80 -148.19 112.97 5.41 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.812 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 56.39 36.74 28.02 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.396 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.43 -13.96 62.42 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.218 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -84.34 122.01 28.33 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.984 0.392 . . . . 0.0 110.812 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -105.38 146.03 29.99 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.135 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.57 138.51 24.76 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.136 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.2 mp -105.75 122.1 58.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.999 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.1 mt -126.27 127.45 70.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.923 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.3 140.76 29.38 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.315 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -137.35 119.85 15.97 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.76 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.0 m -75.63 134.62 40.59 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.081 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.3 mtm180 -75.77 150.42 83.98 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.226 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.06 120.76 7.33 Favored 'Cis proline' 0 C--N 1.349 0.577 0 C-N-CA 123.284 -1.549 . . . . 0.0 112.283 -0.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.6 p -73.77 127.66 35.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.983 0.42 . . . . 0.0 110.993 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.97 130.57 46.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.945 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -55.87 -35.99 67.09 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.997 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.19 -44.49 96.49 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.152 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -66.26 -44.8 82.63 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.703 0.287 . . . . 0.0 111.006 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.1 t -67.16 -46.51 84.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.95 179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -61.4 -42.51 98.84 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.304 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -58.16 -41.87 84.73 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.011 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -46.98 88.31 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.881 179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.0 t -66.25 -45.55 89.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.12 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.1 m -60.09 -38.71 83.74 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.1 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 59.7 m -70.61 -43.58 69.02 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.1 t -58.47 -49.87 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-O 120.526 0.203 . . . . 0.0 111.311 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.455 ' CE2' HD13 ' A' ' 79' ' ' LEU . 77.7 m-85 -83.7 -28.13 28.51 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.04 28.49 34.1 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.668 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -168.94 158.4 7.72 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-O 120.535 0.207 . . . . 0.0 110.899 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.03 124.7 10.79 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.943 2.429 . . . . 0.0 112.217 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.416 HD13 ' CD2' ' A' ' 36' ' ' PHE . 4.0 mp -117.21 151.54 36.68 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.175 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.25 120.99 40.75 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.928 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mp -83.52 125.88 32.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.13 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -113.67 115.57 28.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -111.67 121.85 46.22 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.696 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -115.52 133.27 56.19 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.757 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -74.17 -56.18 5.21 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.77 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -170.04 -57.57 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.39 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.64 -30.32 10.04 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.316 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.6 mt -108.89 145.31 35.57 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.968 0.413 . . . . 0.0 111.389 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 30.2 t -109.78 127.98 55.0 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.952 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.9 mt -118.42 134.44 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.978 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.1 tt -90.69 128.98 36.83 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.841 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.5 mt -81.33 96.96 7.48 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.962 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -108.72 -37.85 5.79 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.226 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -125.96 175.81 7.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.099 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -62.97 -32.63 74.01 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.904 179.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.25 -39.12 72.07 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.353 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -64.16 -50.43 68.2 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.495 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 pp -71.75 -34.45 69.51 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.086 -0.246 . . . . 0.0 110.926 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -63.01 -43.25 99.29 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.786 0.326 . . . . 0.0 111.027 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -33.26 73.71 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.91 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.96 99.69 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.257 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.0 mt -63.88 -42.58 96.31 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.737 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -54.35 -41.83 69.55 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.872 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 29.2 mt -66.7 -41.04 87.48 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.983 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . 0.412 HD13 ' HG ' ' A' ' 75' ' ' LEU . 6.0 mt -65.19 -40.32 94.07 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.113 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -66.75 -32.02 73.04 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.171 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -33.77 76.57 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.48 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.7 t -104.76 134.22 48.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.452 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 94.3 p -77.33 -37.29 52.76 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.989 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.5 p -63.27 -35.85 81.7 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.135 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.07 121.49 27.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.698 0.285 . . . . 0.0 111.068 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -132.17 -52.61 0.96 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.996 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.2 m -70.01 177.94 2.95 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.134 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.412 ' HG ' HD13 ' A' ' 66' ' ' LEU . 1.1 mp -131.9 119.03 20.61 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.157 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -96.65 107.02 19.39 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.32 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.5 mt -128.69 132.19 67.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.904 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.6 mp -102.08 130.72 48.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.626 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.455 HD13 ' CE2' ' A' ' 36' ' ' PHE . 2.0 pp -117.86 136.05 53.7 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.958 0.409 . . . . 0.0 111.215 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mp -137.74 158.45 44.34 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.944 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.9 t . . . . . 0 C--O 1.233 0.207 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.099 179.885 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.242 0 CA-C-O 120.807 0.336 . . . . 0.0 111.236 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.2 t -101.56 129.33 52.88 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.783 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -90.6 105.58 17.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.056 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.99 129.07 71.8 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.208 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.4 mtpt -100.34 126.81 46.73 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.634 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -114.89 127.56 55.77 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.022 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -122.0 131.2 53.87 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.217 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -145.5 128.73 16.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.694 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.73 30.67 20.25 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.221 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.96 -13.96 59.95 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.982 -0.628 . . . . 0.0 113.065 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.33 116.57 28.4 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 117.001 0.401 . . . . 0.0 110.848 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -104.93 135.87 45.48 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.233 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -134.2 154.27 51.35 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.248 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 7.4 mt -115.31 122.25 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.344 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.4 mm -127.49 128.66 70.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.145 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.91 129.05 36.32 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.694 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -117.34 117.61 29.99 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.386 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.02 157.14 38.07 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.173 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -99.84 151.31 37.44 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.469 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.35 145.11 81.25 Favored 'Cis proline' 0 C--N 1.35 0.608 0 C-N-CA 123.414 -1.494 . . . . 0.0 112.801 0.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.6 p -107.42 124.49 63.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.106 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.7 mmtm -102.56 149.88 23.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.236 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -58.11 -48.17 81.03 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.757 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.35 -42.28 95.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.227 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -62.08 -44.33 96.9 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.059 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.3 t -68.83 -48.72 69.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.785 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -40.06 84.62 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.2 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -58.18 -39.89 80.07 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.816 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -70.97 -41.03 71.57 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.752 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 37.8 t -66.64 -42.58 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.186 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 t -65.71 -38.5 89.36 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.146 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.9 m -71.31 -46.79 59.85 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.4 p -60.38 -47.95 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -84.08 -18.09 38.08 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.43 22.63 64.46 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 120.865 -0.683 . . . . 0.0 113.118 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -172.26 149.87 2.22 Favored Pre-proline 0 N--CA 1.463 0.216 0 CA-C-N 116.863 0.331 . . . . 0.0 110.94 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -74.23 106.9 2.32 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.569 2.179 . . . . 0.0 112.125 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mp -104.87 140.04 38.73 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.96 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.47 140.75 41.36 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.017 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mp -101.95 118.52 37.08 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.062 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -105.3 129.69 53.59 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.299 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -109.79 129.01 55.67 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.656 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.1 mtt -125.48 132.41 52.66 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.682 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -97.61 -65.83 0.94 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.686 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -144.87 -71.51 0.27 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.442 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -111.58 -18.23 12.86 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.527 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.3 mp -105.63 139.96 39.43 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.803 0.335 . . . . 0.0 111.35 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.8 m -114.03 125.8 54.4 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.828 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.1 mt -114.0 132.54 62.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.099 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.6 tt -92.38 128.08 38.1 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.8 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 71.9 mt -71.51 100.03 2.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.564 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -90.2 -49.25 6.66 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.424 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -149.06 -170.2 3.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.869 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.69 -32.34 65.34 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.255 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -53.76 -45.66 70.69 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.849 0.357 . . . . 0.0 110.799 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.03 -42.69 84.43 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.166 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.5 mt -67.82 -40.53 83.78 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.272 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -61.66 -43.46 98.81 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.06 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -63.39 -39.4 94.41 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.388 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.64 98.93 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.188 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 6.2 mt -63.78 -45.73 96.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.883 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -44.85 78.32 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.041 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.3 mt -67.09 -39.48 83.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.989 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.4 tp -61.99 -45.45 93.59 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.057 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -56.92 -37.24 71.2 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.256 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -33.24 64.62 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.101 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.3 t -89.07 92.68 9.31 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.256 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 40.6 t -62.99 -34.75 78.2 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.054 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.06 -33.78 67.6 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.318 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.96 129.42 42.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.097 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 47.5 mttt -111.71 -44.69 3.45 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.887 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 60.5 p -101.62 179.04 4.46 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.187 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -123.25 128.93 50.68 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.062 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -88.47 108.57 19.45 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.654 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.9 mt -127.26 131.3 70.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.189 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -102.02 128.29 48.52 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.699 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.5 mt -94.02 122.35 36.43 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.148 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.1 mp -134.1 134.24 42.04 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.114 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.233 0.186 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.996 -179.774 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 . . . . . 0 N--CA 1.469 0.509 0 CA-C-O 120.81 0.338 . . . . 0.0 111.342 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.4 t -99.59 131.58 46.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.208 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -88.96 119.93 29.92 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.746 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.5 mt -115.66 133.63 61.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.192 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.8 mttp -99.43 125.0 45.07 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.834 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -114.11 137.22 52.02 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.182 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.48 133.36 55.42 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.392 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -146.13 116.8 7.62 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.265 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 57.97 33.99 23.8 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.391 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.24 13.31 80.98 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 121.029 -0.605 . . . . 0.0 113.348 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -109.49 120.36 42.27 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 117.237 0.519 . . . . 0.0 110.518 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -92.75 135.21 34.31 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.978 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.38 143.39 50.74 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.036 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.6 mt -110.12 116.02 51.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.199 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.3 mm -128.36 131.46 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.046 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.47 129.88 36.59 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.007 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -127.15 118.38 24.23 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.934 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.95 145.08 34.21 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.972 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -99.85 149.56 36.06 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.171 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.77 121.65 7.95 Favored 'Cis proline' 0 C--N 1.35 0.655 0 C-N-CA 123.361 -1.516 . . . . 0.0 112.899 0.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.7 p -89.86 130.48 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.855 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -84.09 138.25 33.14 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.126 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -55.99 -45.04 79.13 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.234 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.57 -39.62 80.82 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.938 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -63.4 -44.59 94.24 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.047 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t -67.87 -48.88 73.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.016 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -41.18 96.08 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.503 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -45.39 87.38 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.766 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.4 tptm -61.59 -47.58 84.84 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.769 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.1 t -58.93 -48.9 84.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-O 120.668 0.271 . . . . 0.0 110.964 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.4 m -64.28 -39.03 93.11 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.472 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.3 m -71.82 -48.19 48.01 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.85 -48.83 87.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 -179.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -83.28 -22.09 33.11 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.67 -7.73 81.13 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.887 -0.673 . . . . 0.0 113.34 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -131.67 145.57 58.09 Favored Pre-proline 0 CA--C 1.529 0.152 0 CA-C-N 117.279 0.539 . . . . 0.0 110.984 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -75.06 94.4 0.96 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.57 2.18 . . . . 0.0 112.211 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.6 mp -94.68 135.98 35.52 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.888 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.16 140.47 41.75 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.962 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 mt -87.3 100.19 12.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.596 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.44 117.76 30.95 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.497 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -107.07 115.94 31.06 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.361 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.4 ptm -101.3 134.88 43.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.77 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -89.62 -45.46 9.34 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.87 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -173.16 -68.36 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.43 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -108.99 -24.5 11.18 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.505 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 mp -105.03 137.94 42.0 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.789 0.328 . . . . 0.0 111.302 -179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 p -95.62 124.42 39.64 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.596 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.7 134.37 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.735 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.0 tp -102.74 130.84 49.82 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.743 0.306 . . . . 0.0 110.957 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 8.1 mt -78.07 93.35 4.49 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.852 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.15 -37.46 12.1 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.155 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -134.83 171.55 14.22 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.835 0.35 . . . . 0.0 111.337 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.1 tp60 -60.72 -31.61 70.9 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.363 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -52.97 -45.86 67.99 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.773 0.321 . . . . 0.0 110.506 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.16 -39.47 94.76 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.239 179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 17.7 tp -66.29 -42.98 87.58 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.143 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.49 -43.12 99.43 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.836 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.66 -40.63 97.68 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.469 179.11 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.42 -42.93 99.81 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.666 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 mt -63.3 -44.17 99.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 120.521 0.2 . . . . 0.0 110.834 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -55.79 -43.73 77.1 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.253 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.6 mt -68.87 -41.74 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.933 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tp -60.68 -45.05 95.64 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.012 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -58.62 -41.74 86.63 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.996 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.0 ttp85 -71.29 -33.57 69.84 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.611 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.2 p -82.57 103.03 11.8 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.847 0.356 . . . . 0.0 111.284 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 59.8 m -77.91 -38.2 46.2 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.281 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 p -61.96 -33.22 73.88 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.607 0.241 . . . . 0.0 111.562 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.0 tpt -63.17 150.29 43.27 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.99 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.34 105.25 8.41 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.705 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.9 m 66.04 -178.56 0.19 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.097 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.84 123.42 43.08 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.95 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.33 107.14 18.99 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.835 0.35 . . . . 0.0 110.633 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.6 mt -128.1 131.16 69.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.805 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -102.0 124.65 47.98 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.555 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.5 mt -93.63 133.28 37.13 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.211 -179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -140.21 136.16 33.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.367 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.371 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.492 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 . . . . . 0 N--CA 1.468 0.449 0 CA-C-O 120.886 0.374 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -87.18 135.31 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.263 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.2 mtm-85 -92.93 124.5 36.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.913 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.8 mt -113.62 136.79 48.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.151 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -95.65 119.74 34.69 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.864 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -107.71 136.69 47.03 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.907 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -127.42 132.1 50.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.826 0.346 . . . . 0.0 111.551 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.7 t-160 -144.58 123.89 13.03 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.55 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 57.5 35.09 25.46 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.062 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 84.01 -14.19 45.06 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.464 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.83 149.26 37.91 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 117.193 0.497 . . . . 0.0 111.198 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -110.44 135.17 51.55 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.058 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -140.8 143.03 34.61 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.739 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.0 mt -118.06 118.13 57.16 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.996 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.4 mp -126.65 127.02 69.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.242 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.9 146.44 23.75 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.118 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -135.27 134.66 40.18 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.064 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -81.72 125.77 31.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.906 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 ptt180 -93.46 153.46 41.37 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.059 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.1 119.62 6.32 Favored 'Cis proline' 0 C--N 1.351 0.703 0 C-N-CA 123.429 -1.488 . . . . 0.0 112.838 0.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -99.88 130.44 48.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.017 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.6 143.12 31.24 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.779 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -57.1 -36.17 70.31 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.926 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -59.18 -44.76 92.17 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.717 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.72 -40.39 95.25 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.9 t -67.8 -49.01 73.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.114 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -59.32 -39.79 84.23 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.927 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -40.71 89.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.823 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.04 -48.21 71.83 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.223 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 44.1 t -59.69 -43.62 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.245 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.6 m -60.66 -38.98 86.66 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.951 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.7 m -71.76 -44.45 64.03 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 111.461 0.171 . . . . 0.0 111.461 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 34.5 t -59.52 -50.18 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-O 120.49 0.186 . . . . 0.0 111.444 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -83.71 -26.57 29.67 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.24 -11.13 61.84 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.926 -0.654 . . . . 0.0 113.145 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -141.54 156.96 66.46 Favored Pre-proline 0 N--CA 1.465 0.283 0 CA-C-N 116.978 0.389 . . . . 0.0 110.702 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.16 111.68 3.13 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.586 2.191 . . . . 0.0 112.524 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.4 mp -101.68 157.92 16.48 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -99.89 138.05 37.5 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.968 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mp -91.79 112.63 24.63 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.994 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -103.05 111.81 24.34 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.117 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -104.35 117.44 34.19 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.591 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 6.4 mtp -123.49 126.53 46.9 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.824 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -74.0 -59.59 2.65 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.43 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -170.22 -54.75 0.02 OUTLIER 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.431 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -104.32 -31.82 9.37 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.498 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.5 mp -108.76 144.25 36.83 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.79 0.328 . . . . 0.0 111.329 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.2 m -113.59 123.48 50.07 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.994 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -114.53 133.35 60.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.916 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.0 tt -93.65 124.73 37.84 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.982 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.434 HD21 ' HB3' ' A' ' 58' ' ' ASP . 4.2 mt -75.89 94.44 3.35 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.454 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -85.47 -34.31 21.65 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.416 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -160.51 -169.83 2.58 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.776 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -61.2 -29.82 70.04 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.493 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.95 -47.08 68.37 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.795 0.331 . . . . 0.0 110.725 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.434 ' HB3' HD21 ' A' ' 53' ' ' LEU . 1.7 t70 -67.64 -40.47 84.59 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.004 179.441 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 tp -66.8 -37.47 84.61 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.277 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -61.18 -42.79 99.19 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.12 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.92 -35.64 80.46 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.613 179.4 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -37.36 86.84 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.055 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.9 mt -63.83 -40.76 90.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.956 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -53.31 -45.39 68.96 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.864 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.7 mt -69.04 -36.38 73.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.115 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.1 tp -68.91 -41.98 77.48 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.87 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -62.42 -42.39 99.41 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.218 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.2 ptm85 -71.66 -30.46 65.75 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.553 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.7 p -88.99 108.95 19.86 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.892 0.377 . . . . 0.0 111.052 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.2 m -76.07 -34.61 59.57 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.23 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 81.5 p -63.81 -35.0 79.18 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.348 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.8 tpp -84.54 158.67 20.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.959 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.3 tttt -145.6 -54.8 0.29 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.084 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.7 p -93.08 173.9 7.5 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.827 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -122.88 131.04 53.57 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.991 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.2 mtm180 -86.55 109.21 18.96 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.984 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.4 mm -124.88 132.38 71.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.088 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 tp -101.97 131.52 48.33 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.554 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.3 mt -102.19 119.68 39.2 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.051 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.2 mp -141.3 145.39 35.44 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.678 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.4 t . . . . . 0 C--O 1.234 0.239 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.951 179.934 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.4 t0 . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.884 0.373 . . . . 0.0 110.597 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.7 t -99.97 127.37 52.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.959 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.92 121.76 29.85 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.891 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.1 mt -111.61 130.08 65.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.965 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -103.72 113.3 26.72 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.734 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -97.14 143.95 27.45 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.088 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -135.59 127.55 29.55 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.197 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -147.85 118.14 7.35 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.552 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 58.74 35.31 24.3 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.095 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.01 6.79 89.22 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 120.949 -0.643 . . . . 0.0 113.249 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -100.59 111.09 23.29 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 117.162 0.481 . . . . 0.0 110.792 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.3 ptt85 -94.64 141.66 28.35 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.197 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.4 mtt85 -143.72 141.24 30.39 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.054 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 21.8 mt -112.62 128.0 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.185 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.113 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.7 mp -134.07 137.82 51.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.226 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.8 135.85 33.45 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.073 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -135.67 116.84 14.44 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.148 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.14 135.24 34.51 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.975 179.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mtt180 -78.55 155.73 78.52 Favored Pre-proline 0 N--CA 1.463 0.193 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.933 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.93 125.56 11.46 Favored 'Cis proline' 0 C--N 1.35 0.64 0 C-N-CA 123.406 -1.498 . . . . 0.0 112.494 -0.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.0 p -108.04 128.5 63.37 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.004 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.4 mttt -92.83 143.22 26.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.166 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -56.48 -39.44 73.23 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.833 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -64.73 -39.38 93.54 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.937 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -44.19 96.94 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.935 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t -68.73 -48.04 73.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.051 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -59.99 -40.04 87.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.145 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.48 -39.99 81.49 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.665 179.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 tttt -69.13 -46.56 67.34 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.45 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.0 t -59.76 -48.52 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.399 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -60.77 -38.46 85.33 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.491 -179.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 60.8 m -69.83 -45.39 67.93 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.682 0.252 . . . . 0.0 111.682 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.9 t -60.02 -49.27 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.492 0.186 . . . . 0.0 111.352 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -80.96 -23.6 38.67 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.722 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.2 19.64 76.65 Favored Glycine 0 CA--C 1.523 0.574 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.908 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -155.92 148.36 17.74 Favored Pre-proline 0 C--O 1.233 0.217 0 CA-C-N 116.792 0.296 . . . . 0.0 111.005 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.35 104.29 1.83 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.701 2.267 . . . . 0.0 112.325 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mp -109.23 138.32 45.77 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.059 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -81.22 138.42 35.79 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.064 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.2 mp -90.61 120.66 31.86 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.871 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -108.27 116.76 32.56 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.235 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -110.32 120.36 42.17 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.83 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -130.44 135.58 48.14 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.831 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -77.4 -62.55 1.62 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.863 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.85 -53.69 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.366 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -104.5 -32.46 8.97 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.417 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.49 137.32 44.69 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.692 0.282 . . . . 0.0 111.236 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.7 m -113.82 130.4 56.47 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.841 179.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.4 mt -124.01 133.01 70.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.195 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.2 tt -89.68 131.33 35.71 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.821 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.3 mt -87.58 103.85 15.95 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.896 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -109.12 -36.55 6.03 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.025 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -128.05 174.48 9.18 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.171 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.56 -32.48 73.45 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.074 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -54.12 -41.54 68.45 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.034 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -63.39 -47.5 81.79 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.012 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.06 -40.16 90.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.89 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.05 -42.97 99.75 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.731 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.57 -33.39 74.92 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.961 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.44 -37.21 84.98 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.275 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.8 mt -65.77 -43.91 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.645 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.16 -45.36 91.21 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.079 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 26.3 mt -68.26 -41.42 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.091 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.2 tp -68.74 -39.81 80.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.165 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -62.48 -41.89 99.1 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.653 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.6 ptt180 -67.7 -26.99 66.45 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.622 0.249 . . . . 0.0 110.958 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.1 t -70.34 127.33 32.38 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.716 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.1 m -60.82 -37.08 80.77 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.421 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -65.57 0.66 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.196 -179.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 9.9 ptt? 37.94 66.36 0.48 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.437 0.46 . . . . 0.0 111.846 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm -110.05 89.32 2.99 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.6 m 63.32 170.34 0.15 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.637 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.8 mp -110.33 122.69 48.29 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.102 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.63 107.44 19.43 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.648 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.9 mt -129.67 131.36 66.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.87 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.1 tp -101.9 126.87 48.89 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.617 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.5 mt -93.56 134.38 35.91 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.005 -179.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 pp -150.95 144.09 24.72 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.987 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.2 m . . . . . 0 C--O 1.233 0.205 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.124 -179.919 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.403 0 CA-C-O 120.985 0.421 . . . . 0.0 111.483 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.1 t -139.85 123.51 18.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.204 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.2 108.39 19.27 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.571 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.8 mt -108.43 125.07 65.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.97 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -95.63 120.36 35.73 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.658 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -113.1 127.41 56.19 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.66 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -123.35 139.86 53.6 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.948 0.404 . . . . 0.0 111.429 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -137.89 114.44 10.41 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.451 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 61.22 38.14 16.89 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.125 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.09 -14.33 59.26 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.332 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.41 105.98 17.95 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 117.073 0.436 . . . . 0.0 110.783 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.44 156.23 17.87 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.073 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.1 157.92 43.77 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.046 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.5 mt -114.64 120.29 63.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.7 mt -130.71 126.92 61.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.732 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.09 146.51 24.26 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.212 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -138.46 132.84 31.93 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.049 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 p -81.36 165.9 20.93 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.201 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -110.25 143.87 28.95 Favored Pre-proline 0 CA--C 1.529 0.159 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.13 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.52 136.0 41.27 Favored 'Cis proline' 0 C--N 1.35 0.634 0 C-N-CA 123.362 -1.516 . . . . 0.0 112.576 -0.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.0 p -88.77 129.43 39.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.031 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -100.49 130.71 46.6 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -54.73 -45.26 74.09 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.113 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -58.76 -42.44 88.91 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.049 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -62.88 -44.26 96.57 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.005 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.5 t -64.69 -48.24 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.874 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.09 -36.48 81.83 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.014 179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -58.36 -36.91 74.18 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.13 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mttt -72.91 -47.92 41.62 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.669 0.271 . . . . 0.0 110.523 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.73 -45.43 94.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.264 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -61.67 -38.62 88.43 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.444 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -71.4 -44.29 65.19 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.0 t -60.67 -50.26 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -179.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.484 ' CD2' HD13 ' A' ' 40' ' ' LEU . 77.9 m-85 -83.82 -24.78 30.82 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.53 24.81 32.25 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.913 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -177.43 147.58 0.67 Allowed Pre-proline 0 N--CA 1.465 0.296 0 CA-C-N 116.638 0.219 . . . . 0.0 110.611 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.83 108.4 2.56 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.397 2.065 . . . . 0.0 112.0 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.484 HD13 ' CD2' ' A' ' 36' ' ' PHE . 5.1 mp -89.79 140.8 29.24 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.088 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -75.83 120.34 21.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.013 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.6 mt -86.71 122.9 31.25 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.449 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -112.89 124.4 52.53 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.111 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -108.51 129.01 55.3 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.554 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 6.1 mtt -117.44 127.02 53.61 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.726 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -86.56 -51.93 5.86 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.719 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -173.54 -63.12 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.422 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.61 -27.52 11.3 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.489 179.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.13 153.2 26.06 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.901 0.381 . . . . 0.0 111.31 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.4 t -117.22 128.69 55.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.768 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.8 mm -113.85 133.44 59.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.611 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.8 tt -95.79 130.06 42.83 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.172 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 mt -81.95 107.88 15.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.987 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -38.65 4.67 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.408 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -131.67 -179.39 5.35 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.091 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -64.63 -30.19 71.2 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.816 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -57.91 -39.32 77.65 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.583 0.23 . . . . 0.0 110.928 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -68.46 -43.28 77.34 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.832 0.348 . . . . 0.0 110.488 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.56 -44.78 95.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.933 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.23 -41.46 98.43 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.7 mtpm? -66.15 -36.74 83.92 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.217 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.9 -41.48 99.44 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.599 0.238 . . . . 0.0 111.522 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 11.8 mt -66.12 -43.25 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.587 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.9 -42.7 76.41 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.177 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 14.7 mt -66.43 -42.16 89.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.042 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.8 tp -59.78 -44.58 93.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.887 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.54 -35.96 70.99 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.902 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.2 ttt-85 -70.61 -35.12 72.82 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.298 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.5 t -86.49 94.19 9.36 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.718 0.294 . . . . 0.0 111.048 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 91.2 p -58.79 -36.98 75.33 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.145 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.2 p -60.35 -33.68 72.76 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.389 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.0 mtt -85.88 123.7 31.53 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.187 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.91 -33.95 7.78 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.233 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -116.65 156.46 27.02 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.583 0.23 . . . . 0.0 110.962 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.88 129.35 37.87 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.662 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.17 107.82 20.42 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.048 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.9 mp -128.08 132.16 68.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.956 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.7 tp -102.51 118.29 36.54 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.912 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 pp -110.96 135.41 51.52 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.949 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.1 mp -137.54 148.05 45.64 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.162 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 m . . . . . 0 C--O 1.233 0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.696 179.713 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 . . . . . 0 N--CA 1.466 0.353 0 CA-C-O 120.867 0.365 . . . . 0.0 111.273 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.1 t -87.48 127.81 40.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.245 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -98.54 106.87 19.2 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.685 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.0 mp -109.19 133.77 53.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.307 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.82 105.13 13.86 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.546 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -93.17 148.52 21.95 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.15 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -135.7 125.08 24.84 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.982 0.42 . . . . 0.0 111.153 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.2 t-160 -142.16 129.45 21.1 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.514 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.45 29.44 19.01 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.29 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 86.79 -14.1 57.17 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 120.875 -0.679 . . . . 0.0 113.304 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -91.67 132.04 36.64 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 117.078 0.439 . . . . 0.0 110.903 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -101.9 147.7 26.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.184 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -137.1 141.28 42.33 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.969 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.8 mt -111.72 120.76 62.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.125 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.5 mt -133.3 132.74 58.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.141 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.31 141.65 33.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.164 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -123.77 134.94 53.57 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.342 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.6 m -87.47 134.85 33.54 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.142 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.51 149.23 74.81 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.968 179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.22 121.99 8.28 Favored 'Cis proline' 0 C--N 1.35 0.651 0 C-N-CA 123.312 -1.537 . . . . 0.0 112.5 -0.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.0 p -83.04 119.63 32.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.785 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.0 mmmt -98.74 143.79 28.7 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.946 -179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -54.63 -41.41 69.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.001 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.84 -44.48 96.9 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.76 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -62.63 -44.2 96.88 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.259 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.5 t -67.25 -48.4 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.105 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.04 -39.05 77.45 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.811 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -58.92 -45.8 89.49 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.836 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.7 mmtt -61.11 -47.88 84.26 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.946 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.2 t -59.0 -46.83 91.42 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.725 0.298 . . . . 0.0 110.849 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 22.5 m -61.54 -40.16 93.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.287 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 58.9 m -71.73 -46.22 59.28 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.1 t -62.79 -50.1 81.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 121.224 -0.19 . . . . 0.0 111.495 -179.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -83.86 -19.39 34.94 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.88 -20.42 49.95 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.958 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -134.81 147.36 62.65 Favored Pre-proline 0 N--CA 1.462 0.141 0 CA-C-N 116.816 0.308 . . . . 0.0 110.387 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.79 99.25 1.05 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.395 2.063 . . . . 0.0 112.269 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 mp -87.82 156.8 19.22 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.026 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -91.12 140.28 29.97 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.975 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.64 107.47 19.23 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.99 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 113.9 27.7 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.994 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.402 ' CD2' HG12 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -91.68 129.15 37.7 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.219 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -125.35 118.23 25.46 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.951 0.405 . . . . 0.0 110.707 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -88.86 -71.47 0.59 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.049 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -136.19 -72.11 0.45 Allowed 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.37 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -120.9 19.44 11.72 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.127 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.72 147.46 52.51 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.766 0.317 . . . . 0.0 111.134 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.0 p -119.17 126.66 52.09 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.58 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mp -113.62 131.53 65.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.626 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -107.29 121.36 44.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.255 -179.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.6 mt -77.3 95.53 4.38 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.565 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.08 -34.85 11.57 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.134 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -138.24 173.18 11.89 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.847 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -59.26 -34.71 72.57 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.219 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -53.88 -41.14 67.22 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.916 0.389 . . . . 0.0 110.736 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -39.77 94.87 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.011 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 tp -65.35 -43.27 91.39 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.886 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.85 -41.55 97.97 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.797 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -65.21 -36.73 85.1 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.957 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.47 -39.17 92.55 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.499 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 25.4 mt -64.23 -43.18 97.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.751 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.43 -39.27 70.05 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.187 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.8 mt -67.32 -44.62 87.16 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.133 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.63 -47.24 86.38 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.537 -0.302 . . . . 0.0 110.683 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -64.26 -37.39 87.31 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.7 -33.03 74.95 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.2 179.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.1 t -67.02 136.24 54.97 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.83 0.348 . . . . 0.0 111.252 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 18.2 m -74.77 -25.75 59.28 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.501 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.1 t -134.4 82.35 1.96 Allowed 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.06 0.457 . . . . 0.0 110.578 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 30.7 tpp -158.25 105.44 1.91 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.596 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -102.82 -63.15 1.19 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.028 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.8 t -82.0 158.17 23.94 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.181 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.2 mp -101.15 125.22 47.76 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.102 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 107.38 19.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.662 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.402 HG12 ' CD2' ' A' ' 44' ' ' TYR . 22.1 mt -129.44 131.77 67.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.829 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.82 132.32 47.65 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.636 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 10.0 mt -93.66 128.81 40.02 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.174 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.9 mt -133.96 136.24 44.04 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.463 0.184 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.767 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 . . . . . 0 N--CA 1.468 0.461 0 CA-C-O 120.789 0.328 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.8 t -97.78 135.96 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.328 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.0 114.37 23.55 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.113 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.0 mm -109.06 119.75 59.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.901 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.41 114.46 26.23 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.746 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -100.37 140.32 34.79 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.184 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.72 124.74 20.03 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.124 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -138.89 112.04 7.99 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.575 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 58.46 36.3 25.24 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.353 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.69 -14.27 61.98 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.886 -0.674 . . . . 0.0 113.096 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.8 104.55 11.39 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.957 0.379 . . . . 0.0 110.622 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptp85 -92.3 136.85 32.86 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.189 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.0 ttt85 -137.06 143.53 42.68 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.162 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.93 120.71 61.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.864 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.8 mt -134.72 132.55 54.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.168 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.59 143.83 25.94 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.128 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -129.99 121.14 25.94 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.282 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -76.11 129.41 36.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.838 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -70.25 150.73 95.94 Favored Pre-proline 0 N--CA 1.463 0.212 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.086 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -75.24 134.13 34.52 Favored 'Cis proline' 0 C--N 1.35 0.651 0 C-N-CA 123.705 -1.373 . . . . 0.0 112.472 0.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.6 p -84.12 118.32 31.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-O 120.944 0.402 . . . . 0.0 110.792 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.3 mmtm -101.1 129.94 47.07 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.862 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -55.55 -45.16 77.28 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.952 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -60.1 -42.32 94.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.053 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.49 -44.07 97.27 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.036 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.3 t -66.75 -48.0 81.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.577 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.8 -41.59 87.12 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.207 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -57.31 -45.36 84.28 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.877 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 tttm -66.54 -47.83 71.65 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.691 -0.232 . . . . 0.0 110.989 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 45.8 t -58.34 -43.67 86.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.711 0.291 . . . . 0.0 110.982 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 97.2 m -62.84 -38.92 92.7 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.905 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.6 m -71.68 -45.61 61.39 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.384 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.9 t -58.88 -49.69 82.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 120.524 0.202 . . . . 0.0 111.509 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -83.4 -26.91 29.99 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.76 25.54 32.1 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.954 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -169.97 145.67 2.48 Favored Pre-proline 0 N--CA 1.464 0.265 0 CA-C-N 116.871 0.335 . . . . 0.0 110.96 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.52 103.52 1.56 Allowed 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.586 2.191 . . . . 0.0 112.394 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.9 mp -96.26 154.92 16.99 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.107 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -88.72 140.97 28.9 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.997 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.5 mt -100.71 124.05 45.78 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.606 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -117.0 129.32 55.95 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.162 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -114.32 129.69 56.65 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.763 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.4 mtm -111.31 113.36 25.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.542 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.9 p-10 -67.17 -52.59 39.46 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.282 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -148.84 -73.9 0.18 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.331 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -119.67 14.13 12.58 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.336 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.48 148.72 52.66 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.66 0.267 . . . . 0.0 111.164 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.4 m -112.21 128.76 56.34 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.112 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.7 mp -115.96 132.1 66.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.925 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -81.88 134.31 35.39 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.706 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp -102.65 104.03 14.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.059 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.43 -35.92 6.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.358 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -120.17 170.83 8.95 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.771 0.319 . . . . 0.0 111.051 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.48 -35.51 77.87 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.03 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -55.07 -41.16 71.16 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.069 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -64.03 -47.25 80.97 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.68 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.17 -41.88 99.3 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.149 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -43.07 99.81 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.01 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -34.07 77.23 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.132 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.57 -35.34 79.19 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.275 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.8 mm -64.24 -44.56 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.627 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -40.88 71.82 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.118 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 37.1 mm -63.34 -45.14 98.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.912 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 tp -62.8 -44.66 95.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.719 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -64.32 -34.7 78.75 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.274 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -32.13 71.73 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.054 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -70.9 154.15 42.07 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.047 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.3 p -76.22 -33.66 59.23 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.362 179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.7 p -70.66 -76.01 0.11 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.525 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.2 ttt 53.33 82.8 0.07 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.849 0.357 . . . . 0.0 111.217 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.85 -39.69 3.24 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.94 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.3 t -155.76 162.67 40.47 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.533 0.206 . . . . 0.0 110.946 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -94.43 128.22 40.84 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.088 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.84 109.6 20.93 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.97 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.7 mt -128.79 128.64 67.84 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.925 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.99 131.3 48.49 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.741 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.3 mt -100.56 133.05 45.58 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.039 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -156.57 135.71 12.01 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.464 0.271 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.88 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.1 p -149.82 78.09 1.34 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.871 0.367 . . . . 0.0 111.044 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -169.83 80.34 0.11 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.073 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.0 t -82.07 134.81 26.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.799 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.2 ttm105 -97.97 113.01 24.73 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.531 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.0 mp -114.61 134.09 58.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.185 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -104.33 114.66 29.04 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.878 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -102.52 143.45 32.2 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.153 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.418 ' HG3' ' HG3' ' A' ' 14' ' ' ARG . 36.7 tt0 -133.01 129.51 38.25 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.344 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -139.24 115.1 10.12 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.518 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.02 34.28 23.44 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.234 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.44 -14.24 61.71 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 120.995 -0.622 . . . . 0.0 113.253 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -85.06 119.43 25.44 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.996 0.398 . . . . 0.0 110.641 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.418 ' HG3' ' HG3' ' A' ' 9' ' ' GLU . 2.7 mpt_? -100.05 149.01 23.92 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.195 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.4 mtp-105 -144.41 143.73 31.06 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.32 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mt -103.01 118.85 50.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.842 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 34.1 mt -128.97 135.92 60.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-O 120.77 0.319 . . . . 0.0 111.24 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.15 140.92 37.59 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.337 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -128.3 119.77 25.75 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.026 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.2 t -73.61 125.77 28.78 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.017 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -63.15 148.21 93.31 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.237 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.19 134.01 33.4 Favored 'Cis proline' 0 C--N 1.35 0.612 0 C-N-CA 123.33 -1.529 . . . . 0.0 112.61 0.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.6 p -79.58 114.28 20.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 121.014 0.435 . . . . 0.0 110.948 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.53 140.64 36.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.197 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -59.15 -38.47 79.76 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.929 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.44 -45.06 95.03 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.637 0.256 . . . . 0.0 111.099 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.29 -42.33 88.53 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.179 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 40.8 t -70.33 -48.99 57.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.07 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.75 -44.53 96.72 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.444 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -58.52 -39.0 78.92 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.559 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.05 -47.61 70.81 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.761 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.51 -44.34 99.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.149 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.8 m -62.43 -39.1 92.22 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.23 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.0 m -71.68 -45.08 63.02 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 121.253 -0.179 . . . . 0.0 111.467 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 50.8 t -60.14 -50.19 81.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.492 0.187 . . . . 0.0 111.373 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -82.33 -25.24 34.07 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.05 22.05 69.44 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.996 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -152.63 152.0 27.92 Favored Pre-proline 0 N--CA 1.463 0.217 0 CA-C-N 116.949 0.374 . . . . 0.0 110.997 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.64 85.0 1.16 Allowed 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.599 2.2 . . . . 0.0 112.131 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.7 mp -85.83 145.09 27.36 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.225 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -97.78 139.73 33.22 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.952 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.8 mt -98.54 127.83 44.63 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.981 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -115.31 116.29 28.05 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.082 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -91.87 108.15 19.72 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.894 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -104.99 117.5 34.16 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.476 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -76.32 -59.97 2.54 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.785 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -178.38 -51.04 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.265 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -103.58 -31.98 9.66 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.522 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.5 tp -119.8 156.4 30.7 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.805 0.336 . . . . 0.0 111.637 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.9 t -116.74 131.28 56.99 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.136 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.9 mm -114.29 133.84 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.977 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.412 ' CD2' ' HG2' ' A' ' 54' ' ' LYS . 5.7 tt -96.55 135.19 38.79 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.768 0.318 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.0 mt -87.83 102.1 14.36 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.176 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.412 ' HG2' ' CD2' ' A' ' 52' ' ' LEU . 0.0 OUTLIER -106.35 -35.17 7.22 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.349 179.74 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 22.9 p30 -142.8 -179.94 6.63 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.314 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -61.2 -33.62 73.76 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.814 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -53.06 -42.82 66.17 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.951 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -65.28 -44.59 87.54 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.903 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 12.7 tp -67.81 -40.15 83.87 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.09 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.21 -43.25 99.18 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.781 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -64.48 -44.0 92.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.416 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.23 -45.67 92.31 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.864 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 15.0 mt -66.47 -42.16 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 120.556 0.217 . . . . 0.0 110.925 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -56.76 -45.63 81.95 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.244 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 15.9 mt -70.28 -41.24 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.235 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.25 -46.85 88.67 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.952 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.3 -38.43 89.35 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.733 0.302 . . . . 0.0 110.83 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 mmm180 -62.43 -33.75 75.42 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.281 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.9 t -87.69 103.12 15.3 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.978 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 85.5 p -61.78 -31.95 72.19 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.288 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.7 m -60.32 -42.74 96.24 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.924 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mtt -68.61 151.41 46.77 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.119 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -135.83 -64.74 0.61 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.212 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.36 173.0 8.99 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.023 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.9 mp -112.97 125.82 54.81 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.103 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 mtt-85 -92.57 107.49 19.25 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.711 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.4 mt -129.59 132.25 66.37 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.868 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.3 tp -102.08 127.38 49.0 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.71 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.6 mt -93.67 127.71 39.5 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.099 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mp -132.5 142.97 49.44 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.867 0.365 . . . . 0.0 111.375 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 p -85.47 87.85 7.44 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.968 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -118.95 76.0 1.07 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.359 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -92.18 96.22 10.18 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.416 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 67.91 107.1 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.522 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -95.54 84.81 4.04 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.974 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 64.26 170.5 0.18 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.663 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -97.5 86.93 3.97 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.921 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.53 -178.26 3.89 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.918 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -122.13 123.86 42.54 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.916 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -112.66 100.47 8.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.903 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -129.62 132.01 46.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.008 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.8 112.03 9.75 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.848 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 28.5 t60 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.36 -0.828 . . . . 0.0 111.106 179.969 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 120.666 0.269 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.428 ' O ' ' HA ' ' A' ' 20' ' ' SER . 1.6 m -118.8 154.53 32.69 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.258 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -165.08 94.64 0.66 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.818 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 39.5 t -71.82 131.05 35.11 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.107 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -86.65 110.45 19.86 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.96 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 21.7 mt -113.56 129.46 69.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.95 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -100.85 123.26 44.78 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.812 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -115.54 133.46 56.02 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.009 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -134.1 127.63 32.52 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.909 0.385 . . . . 0.0 111.326 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -148.43 131.19 16.02 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.59 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 60.51 29.54 19.09 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.266 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.29 -13.86 59.0 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.857 -0.687 . . . . 0.0 113.288 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -83.22 107.74 15.97 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 117.056 0.428 . . . . 0.0 110.942 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.0 ptt180 -97.27 135.99 38.4 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.108 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 -149.75 155.47 40.2 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.3 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.3 mt -117.83 120.09 63.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.848 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.9 mt -117.39 132.14 68.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.252 -179.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.67 137.07 38.65 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.092 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -128.85 125.88 38.62 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.044 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 2' ' ' SER . 78.3 p -67.75 139.37 56.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.177 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.4 mtm180 -88.9 149.67 43.99 Favored Pre-proline 0 C--O 1.234 0.241 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.144 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -74.63 122.34 8.0 Favored 'Cis proline' 0 C--N 1.351 0.669 0 C-N-CA 123.64 -1.4 . . . . 0.0 112.498 0.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.3 p -70.59 125.36 28.72 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.755 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.9 mttp -95.88 130.37 42.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -56.17 -38.41 70.88 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.741 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.86 -44.36 94.18 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.826 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.46 -41.62 88.77 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.252 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.3 t -68.03 -48.99 72.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.971 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.26 -43.08 92.47 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.848 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 -42.18 80.73 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.911 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.43 -48.1 79.19 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.222 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.0 t -62.6 -42.47 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.287 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.5 m -63.93 -39.06 93.3 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.044 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 35.0 m -71.51 -47.15 57.15 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.3 t -58.54 -49.46 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 120.52 0.2 . . . . 0.0 111.506 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -83.6 -24.66 31.38 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.85 26.29 67.35 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.98 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -157.78 155.94 27.62 Favored Pre-proline 0 C--O 1.233 0.189 0 CA-C-N 116.864 0.332 . . . . 0.0 111.173 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.94 95.65 0.91 Allowed 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.657 2.238 . . . . 0.0 112.165 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mp -100.32 148.6 24.5 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.068 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -100.47 139.78 35.66 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.996 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 35.6 mt -87.68 106.3 17.95 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.662 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -100.53 114.93 28.96 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.017 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -93.46 126.9 38.85 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.168 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -128.26 116.83 20.46 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.812 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -77.5 -49.18 15.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.436 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -172.83 -62.93 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.476 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.65 -23.64 11.35 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.771 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.35 141.07 36.57 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.839 0.352 . . . . 0.0 111.581 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.59 128.16 55.54 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.964 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.2 mt -122.16 133.08 69.57 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.758 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.5 tt -95.07 135.32 36.75 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 mt -97.15 108.79 21.59 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.94 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -107.84 -40.94 5.12 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.221 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.1 p-10 -129.93 179.65 5.74 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.474 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -61.63 -30.92 71.02 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.185 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.25 -46.72 72.66 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.057 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -68.61 -37.52 79.83 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.847 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 tp -66.9 -43.7 82.72 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.805 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -66.53 -37.42 84.98 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.154 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -37.01 84.39 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.762 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.37 -43.64 90.15 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.081 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 39.4 mm -64.12 -43.25 97.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.143 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -53.82 -46.02 71.0 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.859 0.361 . . . . 0.0 110.848 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.6 mt -64.53 -39.43 85.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.966 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tp -65.23 -46.73 79.43 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.188 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -61.27 -36.61 80.49 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.686 0.279 . . . . 0.0 111.061 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.9 mtt-85 -60.39 -33.53 72.61 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.421 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.6 p -80.32 132.97 35.89 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.728 0.299 . . . . 0.0 111.168 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.2 p -76.21 -33.87 59.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.681 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.2 p -97.31 38.13 1.28 Allowed 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.82 142.78 44.6 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.808 0.337 . . . . 0.0 111.508 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.96 73.37 1.48 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.848 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.7 t 60.64 -169.05 0.16 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.488 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.2 mp -111.01 133.4 53.43 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.024 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.4 mtt85 -101.61 107.49 18.76 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.835 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.9 mt -129.47 132.13 66.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.872 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.98 120.58 40.64 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.668 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.8 mt -95.76 124.85 39.97 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.95 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.3 mt -137.41 147.71 45.63 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.006 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.2 m -76.81 122.97 25.54 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.074 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -121.17 36.5 4.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.381 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -159.22 79.67 0.75 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.934 0.397 . . . . 0.0 110.843 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.07 74.86 4.08 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.421 -179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -141.88 -177.16 5.07 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.105 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.69 157.18 37.76 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.837 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -90.69 -40.07 12.08 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.191 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.9 m170 -137.74 143.79 41.35 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.748 0.309 . . . . 0.0 111.162 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -147.08 140.3 25.35 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.996 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 63.75 90.9 0.08 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.121 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -92.74 131.61 37.66 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.126 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -76.97 154.77 33.22 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.077 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.057 -0.973 . . . . 0.0 111.384 179.964 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 120.476 0.179 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.1 p -162.41 91.5 0.77 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.0 0.429 . . . . 0.0 111.099 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -163.92 96.31 0.81 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.466 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 24.2 t -70.23 126.55 30.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.608 0.242 . . . . 0.0 110.604 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -86.89 112.75 22.07 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.047 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.9 mt -113.23 136.02 50.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.901 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -97.63 127.79 43.85 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.829 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -108.89 134.74 51.16 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.997 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.24 125.87 50.16 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.263 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -149.2 123.4 9.53 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.556 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 57.99 35.52 25.33 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 120.93 0.395 . . . . 0.0 110.878 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.19 12.76 76.29 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.126 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -100.98 145.77 28.26 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.934 0.367 . . . . 0.0 110.96 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -97.79 142.74 29.18 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.217 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.29 136.91 26.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.188 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.4 mm -115.16 112.38 39.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.865 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 24.3 mm -129.56 125.98 62.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.928 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.74 146.47 26.5 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.307 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -131.26 120.95 23.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.836 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.4 p -68.08 145.41 54.45 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.968 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 mtt85 -87.55 143.17 33.59 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.086 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -77.52 144.32 76.89 Favored 'Cis proline' 0 C--N 1.349 0.602 0 C-N-CA 123.337 -1.526 . . . . 0.0 112.81 0.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.1 p -99.24 130.44 48.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.989 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -102.27 133.19 47.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.805 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -57.88 -38.51 75.89 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.927 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.81 -44.11 97.29 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.994 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.94 -44.29 96.48 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.125 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.9 t -61.29 -48.14 90.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.788 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.19 -43.97 89.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.229 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -57.73 -47.05 83.54 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.988 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.05 -44.7 96.99 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.861 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.487 ' CG1' HD13 ' A' ' 40' ' ' LEU . 38.5 t -61.24 -42.7 94.48 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.914 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.4 m -61.66 -39.5 91.61 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.969 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.6 m -71.58 -47.96 51.4 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.755 -0.202 . . . . 0.0 111.373 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.7 t -61.84 -50.16 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-O 120.62 0.248 . . . . 0.0 111.245 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -78.25 -24.13 47.02 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.649 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.61 19.17 74.13 Favored Glycine 0 CA--C 1.525 0.662 0 C-N-CA 121.07 -0.585 . . . . 0.0 113.166 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -168.4 154.31 6.76 Favored Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 116.867 0.334 . . . . 0.0 110.74 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.78 143.62 46.43 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.584 2.189 . . . . 0.0 112.387 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.487 HD13 ' CG1' ' A' ' 32' ' ' VAL . 1.1 mp -138.07 163.34 31.85 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.072 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.6 125.88 51.16 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 75.2 mt -84.29 113.33 21.05 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.035 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 121.65 44.62 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.193 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -108.31 116.67 32.39 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.365 179.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.3 mtt -104.3 133.67 48.81 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.984 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -90.8 -51.13 5.52 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.742 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -171.41 -62.47 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.531 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -107.98 -29.15 9.17 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.43 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.21 160.22 16.0 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.914 0.388 . . . . 0.0 111.32 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.44 132.38 56.24 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.901 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.8 mt -113.65 134.38 56.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.83 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.08 126.73 35.26 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.182 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.7 mt -88.16 86.48 7.1 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.648 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -106.0 -33.0 8.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.292 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -117.11 158.61 23.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.726 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -59.9 -35.01 73.95 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.711 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.14 -39.96 70.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.117 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -60.75 -45.51 94.03 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.91 0.386 . . . . 0.0 110.793 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 tp -71.04 -38.31 72.54 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.001 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.61 -43.15 90.5 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.108 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -34.37 77.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.954 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.36 -39.77 94.23 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.299 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.4 mm -66.48 -42.88 90.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.595 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -59.03 -45.36 90.93 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.984 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.5 mt -65.75 -44.44 93.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.026 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.5 tp -63.67 -37.96 89.3 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.173 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -57.47 -38.15 74.05 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.995 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.98 -31.56 69.33 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.036 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.9 t -66.69 138.24 57.27 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.802 0.334 . . . . 0.0 111.355 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.9 m -75.55 -35.15 60.73 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.43 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 53.2 p -96.39 37.41 1.26 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.45 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.94 105.45 0.57 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.776 0.322 . . . . 0.0 110.775 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.46 86.9 2.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.588 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 p 55.33 -173.8 0.05 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.416 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -112.75 130.22 56.14 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -92.99 107.76 19.47 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.916 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.5 mt -129.54 131.18 67.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.763 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.76 118.8 37.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.42 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -119.95 129.58 54.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.006 -179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.72 147.39 32.93 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.644 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.56 82.06 0.17 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.05 0.452 . . . . 0.0 110.808 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.43 44.31 0.7 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.472 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -73.36 90.2 1.65 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.5 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.8 mtt180 -148.91 -81.06 0.12 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.111 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -179.3 166.39 1.48 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.78 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 mt 61.75 -176.52 0.13 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.326 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -106.89 178.29 4.6 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -35.43 63.78 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.354 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.02 158.27 0.16 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.326 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 57.13 74.94 0.39 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.429 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -153.93 -46.52 0.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.396 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 -127.14 36.67 4.39 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.75 0.309 . . . . 0.0 111.086 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 26.3 t60 . . . . . 0 C--O 1.252 1.2 0 CA-C-O 118.715 -0.66 . . . . 0.0 111.681 179.734 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.673 0.273 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.409 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 4.0 m -133.62 -174.42 3.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.856 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' A' ' 2' ' ' SER . 7.6 m-20 67.2 109.81 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.216 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.6 t -107.37 117.74 53.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.996 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.23 105.15 17.02 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.501 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.5 mt -100.5 116.89 44.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.245 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -109.03 113.73 26.85 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.643 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.444 ' CD2' HD11 ' A' ' 79' ' ' LEU . 24.3 p90 -117.34 146.13 43.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.244 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -128.34 144.46 51.13 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.354 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -143.37 113.05 6.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.491 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 m120 57.6 39.28 27.73 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.233 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.56 -14.09 60.68 Favored Glycine 0 CA--C 1.524 0.616 0 C-N-CA 120.997 -0.62 . . . . 0.0 113.346 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -86.33 103.69 15.15 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 117.066 0.433 . . . . 0.0 110.636 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.98 140.44 29.65 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.273 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.5 mtt85 -134.72 138.59 44.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.99 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mt -117.48 123.38 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.134 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.7 mt -136.18 132.82 49.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.199 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.74 136.25 42.91 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.036 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -124.84 125.56 44.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.792 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -71.5 124.93 25.75 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -73.0 146.39 87.4 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.056 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -74.79 129.19 17.89 Favored 'Cis proline' 0 C--N 1.349 0.568 0 C-N-CA 123.697 -1.376 . . . . 0.0 112.543 -0.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.2 p -96.55 130.58 44.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.249 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -89.56 139.84 30.14 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.029 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -59.22 -44.91 92.28 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.04 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.35 -38.86 78.06 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.954 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -65.23 -44.45 88.22 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.033 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.2 t -68.19 -49.26 68.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.871 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -59.28 -41.67 89.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.176 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -57.73 -41.68 82.32 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.983 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 tttt -63.29 -48.07 79.65 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.42 -42.14 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.135 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.4 m -65.44 -39.05 91.61 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.228 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.6 m -71.35 -44.71 64.52 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.895 -0.139 . . . . 0.0 111.337 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.33 -50.02 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.509 0.195 . . . . 0.0 111.214 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -80.17 -26.37 39.33 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.742 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.88 26.75 55.32 Favored Glycine 0 CA--C 1.522 0.475 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.823 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -167.21 156.21 9.3 Favored Pre-proline 0 N--CA 1.462 0.169 0 CA-C-N 116.764 0.282 . . . . 0.0 111.0 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.38 109.39 2.83 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.575 2.183 . . . . 0.0 112.279 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.6 mp -107.84 134.84 50.2 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.926 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -84.91 133.07 34.3 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.736 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -92.31 108.81 20.23 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.873 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -104.9 118.93 37.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.22 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -91.04 128.89 37.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.81 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.8 ptm -128.42 114.5 16.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.801 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -85.36 -54.15 4.77 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.546 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -167.12 -64.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.401 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -109.5 -23.71 11.36 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.748 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 tt -111.91 146.92 36.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 120.86 0.362 . . . . 0.0 111.305 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 m -120.52 132.78 55.35 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.896 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mp -116.19 133.8 61.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.658 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 tt -98.12 126.56 43.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.831 0.348 . . . . 0.0 110.86 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.8 mt -70.89 97.89 1.49 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.109 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.29 -38.13 11.67 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.182 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -152.61 -173.69 4.65 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.32 -30.79 69.74 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.267 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -53.21 -50.39 64.79 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.081 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.36 -43.5 98.68 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.986 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.51 -38.05 89.65 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.845 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -61.39 -43.48 98.79 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.731 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -35.53 81.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.908 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.58 -35.32 80.12 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.249 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.2 mt -64.67 -42.76 95.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.748 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.16 -39.56 63.68 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.031 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 13.8 mt -66.32 -39.46 84.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.847 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.3 tp -62.71 -42.85 99.86 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.986 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -64.02 -34.4 77.91 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.336 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 50.8 ttt85 -75.43 -34.05 60.97 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.098 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.6 t -85.74 129.41 34.84 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.344 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.46 -40.49 29.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.015 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -75.36 -41.78 55.7 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.34 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.49 101.3 0.17 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.799 0.333 . . . . 0.0 111.062 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.13 -37.48 11.57 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.933 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -121.55 175.24 6.31 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.723 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -101.99 129.78 48.36 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.694 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -86.75 108.79 18.85 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.007 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.9 mt -124.81 132.08 71.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.095 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 tp -102.17 122.67 44.62 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.483 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.444 HD11 ' CD2' ' A' ' 8' ' ' PHE . 4.6 mt -96.18 135.98 37.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.085 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.04 135.89 14.54 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.984 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.3 p -58.64 107.66 0.54 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.98 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -121.86 62.77 0.93 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.93 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -98.62 50.3 0.98 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.421 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 53.12 33.61 15.48 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.402 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -145.03 158.78 43.71 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.183 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.7 pp -150.82 128.66 11.67 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.287 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.6 75.16 0.93 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.968 0.413 . . . . 0.0 110.783 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -85.18 81.05 8.99 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.918 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -158.23 -176.73 6.07 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.941 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -80.34 149.67 30.18 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.996 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 19.5 p-80 -141.5 144.86 34.57 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.976 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 12.7 m80 -108.62 122.26 46.72 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.38 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.604 -0.712 . . . . 0.0 111.323 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 120.445 0.164 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.3 m 67.61 147.93 0.05 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.131 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 65.07 162.34 0.13 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.749 -179.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -144.81 132.7 16.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.036 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.81 111.28 20.6 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.512 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.403 HD12 ' CG ' ' A' ' 19' ' ' PHE . 27.7 mt -107.56 118.4 55.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.934 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -96.59 123.01 40.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.933 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -115.73 127.15 54.91 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -122.13 132.62 54.56 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.829 0.347 . . . . 0.0 111.043 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -146.04 117.2 7.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.652 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.52 33.22 22.09 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.21 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.71 -14.0 62.72 Favored Glycine 0 CA--C 1.525 0.658 0 C-N-CA 120.937 -0.649 . . . . 0.0 113.077 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -88.04 110.72 20.84 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.941 0.37 . . . . 0.0 110.887 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.66 144.3 28.9 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.201 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.1 mtt85 -133.49 149.81 51.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.993 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.7 mp -115.82 112.76 41.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.803 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.5 mp -123.53 136.91 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 120.861 0.362 . . . . 0.0 111.319 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.13 129.5 42.21 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.027 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.403 ' CG ' HD12 ' A' ' 6' ' ' ILE . 21.4 m-85 -124.76 126.39 45.58 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.967 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 p -66.48 135.74 54.68 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.161 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -100.54 146.31 31.81 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.042 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.21 123.49 9.42 Favored 'Cis proline' 0 C--N 1.35 0.655 0 C-N-CA 123.335 -1.527 . . . . 0.0 112.499 -0.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.54 130.03 36.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.975 0.417 . . . . 0.0 111.254 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.54 146.39 24.62 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.044 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -56.98 -37.27 71.38 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.083 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -61.32 -43.72 98.4 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.919 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.76 -39.18 87.77 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.142 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.7 t -67.96 -48.85 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.872 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -58.7 -44.68 90.38 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.926 179.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -59.99 -37.03 78.48 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.126 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.94 -48.06 55.59 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.857 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.2 t -65.5 -45.75 91.81 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.431 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 t -61.0 -38.93 87.78 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.708 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.6 m -71.24 -43.78 66.62 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.2 t -64.89 -50.53 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 120.576 0.227 . . . . 0.0 111.419 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -83.72 -13.34 54.23 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.26 24.03 71.86 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.88 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -153.15 147.31 18.75 Favored Pre-proline 0 CA--C 1.529 0.172 0 CA-C-N 116.752 0.276 . . . . 0.0 110.961 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.24 71.73 5.05 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.559 2.173 . . . . 0.0 112.124 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.4 mp -76.92 131.55 38.61 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.847 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -76.98 140.09 40.3 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.991 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 33.5 mt -82.18 118.58 23.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.897 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -116.94 119.6 35.83 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.995 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -90.63 117.27 29.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.82 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.7 115.65 22.44 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.827 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -86.53 -72.21 0.51 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.053 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -134.9 -67.43 0.56 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.608 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -122.78 18.56 10.26 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.207 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.0 tp -131.68 138.22 48.62 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.604 0.24 . . . . 0.0 110.979 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.97 122.52 39.54 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.765 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.8 mp -114.44 131.14 67.36 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.684 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.2 tt -92.13 127.88 37.77 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.874 0.369 . . . . 0.0 111.116 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.8 mp -92.95 90.06 6.8 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.789 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.88 -31.82 15.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.145 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -132.08 174.49 10.14 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.989 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.59 -32.05 72.98 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.294 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -54.28 -42.2 69.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.71 0.29 . . . . 0.0 110.94 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.64 -46.19 83.59 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.162 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.3 tp -61.77 -41.92 98.32 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.599 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -61.52 -41.77 97.81 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.734 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.87 -39.49 94.33 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.835 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.81 -38.42 90.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.333 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.5 mt -64.37 -44.04 97.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.599 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -56.0 -42.4 76.35 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.052 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.1 mt -66.12 -45.57 90.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.112 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 8.4 tp -58.9 -43.47 91.04 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.803 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -69.29 -36.77 77.38 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.036 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -26.64 68.8 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.27 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.2 t -62.36 164.72 6.83 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.912 0.386 . . . . 0.0 111.382 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 p -64.06 -40.72 96.89 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.185 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.5 p -163.93 -63.92 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.232 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 63.16 -177.58 0.15 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.135 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -152.61 115.41 4.57 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.789 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.06 -172.2 0.17 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.954 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.2 mp -125.39 125.85 44.06 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.721 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -86.2 107.07 17.73 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.914 0.387 . . . . 0.0 110.606 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 8.2 mt -127.85 131.53 69.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.723 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -101.93 128.95 48.11 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.538 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.4 mt -94.15 133.65 37.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.023 -179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.7 mt -135.37 143.78 46.25 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.146 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t -88.16 101.54 13.92 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.899 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -115.12 30.49 7.32 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.728 179.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -72.18 119.45 16.39 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.8 0.333 . . . . 0.0 111.022 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.6 mtm180 -136.69 -53.96 0.72 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.88 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 66.37 148.31 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.368 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 87.1 mt 68.98 146.6 0.06 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.641 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 62.45 98.98 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.404 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -134.61 -73.69 0.47 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.736 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -172.07 41.89 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.992 0.425 . . . . 0.0 110.436 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -148.34 -47.33 0.15 Allowed 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.108 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 63.66 28.63 15.06 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.67 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 70.2 137.14 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.797 0.332 . . . . 0.0 111.43 179.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 3.3 m80 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 117.903 -1.046 . . . . 0.0 111.016 -179.85 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.435 ' HB2' ' HB2' ' A' ' 21' ' ' ARG . 3.4 m -151.37 -174.9 4.97 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.311 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -169.53 137.29 1.78 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.214 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -138.75 141.43 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.245 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -95.01 105.5 17.42 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.916 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.413 ' CD1' ' HB2' ' A' ' 19' ' ' PHE . 2.7 mt -111.72 116.96 53.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.882 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -96.1 118.31 32.43 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.75 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -96.83 129.17 44.3 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.019 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -119.09 128.68 54.55 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.875 0.369 . . . . 0.0 111.691 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -142.2 120.1 11.99 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.525 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 44.1 t30 54.96 38.28 30.21 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.793 0.33 . . . . 0.0 111.072 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 84.52 -14.51 46.09 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 121.168 -0.539 . . . . 0.0 113.588 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -87.32 121.02 29.22 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 117.22 0.51 . . . . 0.0 110.855 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -100.33 154.45 18.48 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.369 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.9 mtt-85 -140.04 139.97 36.07 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.913 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.9 mt -108.75 114.79 47.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.225 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.8 mt -139.88 136.06 38.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.235 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.69 133.57 41.06 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.303 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.413 ' HB2' ' CD1' ' A' ' 6' ' ' ILE . 21.5 m-85 -121.86 129.36 52.53 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.89 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.24 157.87 25.03 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.869 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.435 ' HB2' ' HB2' ' A' ' 2' ' ' SER . 2.0 mtm105 -109.51 153.98 42.56 Favored Pre-proline 0 C--O 1.234 0.253 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.113 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -75.74 131.79 25.4 Favored 'Cis proline' 0 C--N 1.349 0.593 0 C-N-CA 123.189 -1.588 . . . . 0.0 112.756 0.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.9 p -105.6 125.73 60.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.871 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -87.04 137.46 32.33 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.727 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.404 ' CE1' HD12 ' A' ' 42' ' ' LEU . 65.5 t80 -55.68 -38.72 70.01 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.754 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.06 -43.49 95.39 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.165 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -62.63 -43.8 97.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.166 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.8 t -69.09 -45.15 80.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.457 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -61.81 -38.4 87.96 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.358 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.87 -47.46 82.65 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.807 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.2 mtpp -61.4 -46.59 89.52 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.894 179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.2 t -57.47 -48.17 83.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.919 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.7 m -62.33 -39.37 92.87 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.37 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.1 m -71.71 -46.26 59.23 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -61.44 -50.16 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.514 0.197 . . . . 0.0 111.488 -179.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.423 ' CD2' HD12 ' A' ' 40' ' ' LEU . 72.9 m-85 -83.4 -21.46 33.01 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.41 30.35 64.75 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.812 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -168.2 151.87 5.78 Favored Pre-proline 0 N--CA 1.463 0.2 0 CA-C-N 116.59 0.195 . . . . 0.0 111.081 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -75.17 107.38 2.47 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.573 2.182 . . . . 0.0 112.236 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.423 HD12 ' CD2' ' A' ' 36' ' ' PHE . 3.4 mp -105.44 143.16 33.99 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.298 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -88.62 129.46 35.5 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.781 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.404 HD12 ' CE1' ' A' ' 25' ' ' TYR . 50.7 mt -86.12 103.01 14.37 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.904 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -93.08 120.92 33.89 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.101 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -96.86 125.38 41.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.994 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.2 ptp -126.65 114.23 17.76 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.035 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -86.94 -54.3 4.42 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.801 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -157.13 -65.81 0.1 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.506 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -126.2 13.23 7.74 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.533 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.6 tp -131.62 132.96 44.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.628 0.251 . . . . 0.0 110.961 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 m -110.51 126.07 53.99 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.963 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.0 mt -114.63 134.12 58.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.89 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 tt -92.08 122.3 34.45 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.81 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 mt -80.39 87.26 5.65 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.058 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.98 -31.75 14.78 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.382 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -142.85 -179.63 6.46 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.891 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -62.68 -31.35 72.23 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.14 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.24 -43.81 67.62 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.1 0.25 . . . . 0.0 111.099 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.25 -40.05 89.94 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.188 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.5 tp -69.3 -41.38 76.84 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.763 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -65.89 -40.21 91.34 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.341 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.8 tptt -62.67 -36.94 84.5 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.396 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.06 -38.31 90.69 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.343 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 54.0 mt -62.75 -42.52 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.005 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.25 -45.54 72.39 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.119 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 4.9 mt -69.37 -41.92 81.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.906 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 13.7 tp -61.39 -44.52 97.01 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.029 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -61.47 -39.26 90.24 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.045 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 7.8 mtm-85 -62.65 -34.3 76.79 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.243 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.0 t -87.01 119.98 27.78 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.806 0.336 . . . . 0.0 111.212 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 71.9 m -78.19 -32.47 50.08 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.253 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.6 p -93.47 35.7 1.1 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.699 0.285 . . . . 0.0 111.612 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.8 ttp -147.41 80.96 1.52 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.821 0.343 . . . . 0.0 110.816 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -103.18 31.44 4.27 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.335 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.5 m -156.52 142.52 18.03 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.65 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -116.46 131.94 56.81 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 111.189 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -99.72 118.15 35.61 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.048 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.3 mp -125.22 132.39 71.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.759 179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 mt -101.94 119.42 38.77 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.679 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -93.39 119.95 33.1 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.998 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 pp -130.9 136.54 48.69 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.978 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 54.7 p -73.84 145.98 44.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.788 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -95.99 36.14 1.34 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.402 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -134.24 77.06 1.68 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.59 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.82 94.85 4.94 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.905 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.3 m120 60.04 65.79 1.06 Allowed 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.45 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -169.46 88.51 0.17 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.195 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -112.48 -35.48 5.54 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.458 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 66.03 26.71 10.79 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 111.809 0.299 . . . . 0.0 111.809 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 69.25 -69.42 0.16 Allowed 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 122.548 0.339 . . . . 0.0 111.492 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -98.29 -164.01 1.1 Allowed 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 68.3 88.17 0.11 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.989 0.423 . . . . 0.0 111.205 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 17.8 p80 -56.7 -38.25 72.03 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.518 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.9 t60 . . . . . 0 C--O 1.251 1.141 0 CA-C-O 118.433 -0.794 . . . . 0.0 110.898 -179.99 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.585 0.231 . . . . 0.0 111.543 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.2 m 64.25 31.42 13.05 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.011 0.434 . . . . 0.0 110.754 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.37 107.56 15.13 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.424 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -78.21 135.82 25.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.857 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.95 107.25 18.3 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.857 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.3 mt -110.01 120.6 61.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.977 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.09 119.2 38.4 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.669 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.445 ' HB3' HD12 ' A' ' 79' ' ' LEU . 49.7 m-85 -100.74 127.2 47.26 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.481 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -118.82 131.2 56.08 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.874 0.369 . . . . 0.0 111.37 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -141.74 120.62 12.75 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.513 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 m120 56.13 34.99 24.9 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.511 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.13 -14.19 61.37 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 120.915 -0.659 . . . . 0.0 113.159 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -89.43 116.93 27.98 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 117.055 0.428 . . . . 0.0 110.429 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.14 144.16 39.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.394 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.1 mtt-85 -133.98 139.41 46.06 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.9 mp -102.27 118.59 49.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.235 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -137.04 129.96 44.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.974 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.31 142.87 27.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.118 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -133.84 118.08 17.57 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.941 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.5 t -64.62 130.47 43.75 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.977 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -74.46 160.02 82.18 Favored Pre-proline 0 CA--C 1.53 0.195 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.346 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.86 130.17 19.9 Favored 'Cis proline' 0 C--N 1.35 0.609 0 C-N-CA 123.219 -1.576 . . . . 0.0 112.558 -0.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -71.61 125.18 29.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.021 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.17 137.94 39.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.928 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -55.91 -45.03 78.79 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.735 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -39.69 94.44 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.03 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.12 -44.41 95.71 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.105 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 42.6 t -67.97 -48.42 74.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.881 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -39.24 93.48 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.111 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -58.0 -39.4 78.17 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.933 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -69.23 -47.49 64.59 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.062 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.6 t -68.24 -43.6 84.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.477 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.7 m -60.38 -38.66 84.6 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.102 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.4 m -71.49 -43.79 65.91 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 111.464 0.172 . . . . 0.0 111.464 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.1 t -63.34 -50.86 77.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 120.535 0.207 . . . . 0.0 111.42 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -83.48 -18.68 37.7 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.21 21.06 75.55 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 121.067 -0.587 . . . . 0.0 113.052 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -149.71 151.64 33.23 Favored Pre-proline 0 CA--C 1.53 0.178 0 CA-C-N 116.94 0.37 . . . . 0.0 110.933 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -75.32 95.0 0.97 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.634 2.223 . . . . 0.0 112.122 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.8 mp -93.52 145.32 24.6 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.232 -179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -91.96 130.92 37.61 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.733 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 mp -90.2 103.08 15.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.946 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -94.71 120.08 34.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.197 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -99.08 120.54 39.64 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.537 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.02 129.67 56.17 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.671 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -90.46 -50.67 5.82 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.735 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -171.99 -63.63 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.454 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -109.19 -26.69 9.97 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.397 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.27 138.99 40.6 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.754 0.312 . . . . 0.0 111.279 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.2 t -110.31 129.64 55.7 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.888 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.7 mt -120.01 134.09 64.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.811 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.3 tt -99.32 135.1 41.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.676 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.3 mt -73.85 86.48 1.74 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.024 0.44 . . . . 0.0 111.096 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.5 tptp -80.55 -36.63 32.76 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.234 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -152.33 178.54 9.42 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.247 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -58.3 -33.0 68.98 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.09 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.63 -43.47 72.3 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.699 0.285 . . . . 0.0 110.86 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -67.35 -40.44 85.85 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.676 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 9.3 tp -64.49 -44.6 90.45 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.153 179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.3 -38.63 91.9 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.139 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.9 mttt -62.99 -41.93 99.7 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.494 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.82 -45.39 92.83 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.183 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 44.2 mm -65.04 -44.92 95.81 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.134 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.085 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.7 -45.54 85.56 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.379 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.9 mt -70.06 -45.16 77.27 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.969 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.2 tp -63.72 -46.4 85.56 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.375 -179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.78 -40.78 84.99 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.807 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -68.3 -33.59 74.6 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.101 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.6 t -82.31 113.91 20.43 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.923 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 m -75.25 -29.2 60.14 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.997 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.61 -35.26 65.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.184 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 mmm -108.46 154.85 21.31 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.102 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.6 mmtm -134.77 -52.14 0.8 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.709 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.9 p -79.0 169.73 17.76 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.034 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -111.58 121.65 45.71 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.044 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.48 108.19 19.5 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.821 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.8 mt -128.94 132.2 67.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 tp -102.12 119.48 38.88 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.509 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.445 HD12 ' HB3' ' A' ' 8' ' ' PHE . 2.8 mt -93.54 131.64 38.6 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.955 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.0 mp -142.12 138.45 31.66 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.792 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m -65.29 134.85 54.49 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.371 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -107.65 33.88 3.83 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.202 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -155.89 99.01 1.95 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.618 -0.265 . . . . 0.0 110.886 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.45 -50.26 40.15 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.954 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.8 m120 65.68 112.57 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.891 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 tp -94.51 32.21 1.62 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.932 179.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -129.28 162.18 28.51 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.316 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER 70.12 147.7 0.07 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.18 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -135.72 -48.99 0.7 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.03 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -164.97 117.79 1.22 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.988 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -140.86 113.89 8.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.149 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 13.6 p80 -161.47 145.81 13.14 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.842 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.5 m170 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.262 179.955 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 120.85 0.357 . . . . 0.0 111.321 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.7 m -154.43 173.14 16.65 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.109 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 66.88 109.97 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.508 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.9 t -93.05 130.76 41.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.949 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -87.21 113.94 23.38 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.761 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 mm -106.69 123.98 61.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.21 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.66 111.8 23.79 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.752 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.42 ' CE2' ' HB2' ' A' ' 15' ' ' ARG . 11.2 p90 -116.41 149.14 39.91 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.305 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -118.01 139.85 50.6 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.086 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -146.03 114.54 6.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.436 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 t30 58.72 35.01 24.17 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.135 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.72 12.47 81.48 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.071 -0.585 . . . . 0.0 113.177 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -111.29 122.07 46.9 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 117.059 0.43 . . . . 0.0 110.736 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -93.32 139.72 30.34 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.147 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.42 ' HB2' ' CE2' ' A' ' 8' ' ' PHE . 16.0 mmt180 -139.04 136.7 35.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.161 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.4 mp -117.01 129.63 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.221 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 32.7 mt -140.92 129.62 24.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.131 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.6 134.61 34.27 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.031 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -129.2 121.48 27.76 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.045 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p -66.39 136.49 55.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.898 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -77.41 147.22 75.31 Favored Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.993 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.83 133.84 31.9 Favored 'Cis proline' 0 C--N 1.35 0.633 0 C-N-CA 123.347 -1.522 . . . . 0.0 112.625 0.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.7 p -81.46 123.45 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.091 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -102.66 143.76 31.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.01 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -60.27 -42.1 94.71 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.6 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.405 ' HG2' ' CD2' ' A' ' 30' ' ' HIS . 12.2 tt0 -57.89 -41.6 82.88 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.098 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -62.48 -44.45 96.37 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.087 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 37.3 t -70.99 -48.44 55.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.893 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -40.54 85.01 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.392 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . 0.405 ' CD2' ' HG2' ' A' ' 26' ' ' GLU . 4.5 m-70 -57.9 -46.67 84.59 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.697 0.284 . . . . 0.0 111.06 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -48.26 50.92 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.094 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.4 t -56.99 -46.29 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.374 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 91.4 m -61.2 -38.85 88.06 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.952 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.1 m -71.3 -42.27 68.88 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 111.481 0.178 . . . . 0.0 111.481 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 41.5 t -60.2 -49.97 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-O 120.607 0.241 . . . . 0.0 111.068 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -83.61 -25.79 30.55 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.883 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.35 14.0 62.7 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.03 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -154.39 152.16 25.6 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.977 0.389 . . . . 0.0 110.872 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.402 ' HG2' ' CB ' ' A' ' 83' ' ' ASP . 60.5 Cg_endo -72.46 79.74 1.78 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.641 2.227 . . . . 0.0 112.29 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.7 mp -75.31 140.03 42.85 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.878 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.0 136.81 32.79 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.02 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.9 mt -86.19 118.69 25.8 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.91 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.1 m170 -109.07 119.58 39.96 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.063 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.412 ' CB ' HD11 ' A' ' 53' ' ' LEU . 13.0 t80 -120.22 128.35 53.28 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.796 0.331 . . . . 0.0 110.672 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.5 mtm -110.49 118.52 36.47 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.377 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -60.8 -67.5 0.39 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.876 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.88 -59.79 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.37 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -120.96 11.6 11.05 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.604 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -131.22 159.2 38.47 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.689 0.281 . . . . 0.0 111.019 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.4 p -118.1 118.53 32.14 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.05 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.7 mt -113.67 133.9 58.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.858 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.3 tt -96.44 123.29 40.04 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.945 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.412 HD11 ' CB ' ' A' ' 44' ' ' TYR . 7.3 mt -92.34 81.0 4.93 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.864 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.2 tttp -103.5 -32.82 9.29 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.972 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -107.9 165.57 11.36 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.8 0.333 . . . . 0.0 111.102 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.52 -35.85 80.72 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.952 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.47 -42.65 74.63 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.025 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -60.1 -44.48 94.79 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.661 179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 4.9 tt -66.28 -40.69 90.27 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.074 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.11 -41.45 96.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.904 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -66.32 -37.27 84.99 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.061 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.17 -45.42 91.89 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.348 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 42.3 mm -66.11 -41.04 88.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.775 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -55.33 -41.17 72.1 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.085 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 7.6 mt -66.81 -41.43 87.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.922 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.5 tp -62.76 -41.98 99.47 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.007 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -58.62 -38.01 77.13 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.209 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -31.75 64.99 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.298 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.9 t -98.9 93.09 5.84 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.219 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 89.2 p -67.88 -31.31 71.02 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.388 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.2 p -56.43 -43.67 79.65 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.182 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 6.2 ttp -83.47 157.39 22.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.223 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.4 mttm -143.73 -51.28 0.32 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.93 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.9 m -79.6 149.74 31.26 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.076 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -113.9 126.48 55.22 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.898 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.5 mtt-85 -93.02 109.91 21.37 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.944 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 38.6 mt -128.93 132.2 67.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.094 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.7 mp -102.21 132.03 48.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.673 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.7 mt -94.15 132.34 38.78 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.09 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 89.1 mt -143.63 137.31 28.21 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.905 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 p -70.51 117.69 12.37 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.131 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -138.79 37.91 2.18 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.343 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.402 ' CB ' ' HG2' ' A' ' 39' ' ' PRO . 35.6 t70 -119.35 100.0 7.04 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.756 0.312 . . . . 0.0 111.124 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.2 mtt85 -112.88 -42.05 3.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.113 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -173.84 175.57 2.83 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.603 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -88.9 55.85 3.51 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.816 0.341 . . . . 0.0 110.624 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 59.95 -171.56 0.13 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.324 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 56.2 t60 -93.38 128.06 39.27 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.907 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -164.05 178.99 7.25 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.222 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -155.8 173.96 15.99 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.064 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -68.11 140.42 56.21 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.698 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 9.5 t-80 -86.69 136.09 33.15 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.838 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 3.4 m80 . . . . . 0 C--O 1.251 1.133 0 CA-C-O 118.579 -0.724 . . . . 0.0 111.419 -179.97 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 120.563 0.22 . . . . 0.0 111.586 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.4 m 68.44 69.17 0.31 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.086 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -166.32 70.54 0.12 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.887 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -85.72 135.88 24.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.173 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -95.84 106.16 18.26 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.888 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 33.3 mt -101.09 126.38 54.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.018 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -98.83 116.37 30.91 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.913 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -93.38 145.63 24.34 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.247 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.32 132.76 50.2 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.348 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -146.14 113.85 6.42 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.626 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 58.3 33.74 23.42 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.12 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.96 -13.64 62.56 Favored Glycine 0 CA--C 1.526 0.719 0 C-N-CA 120.917 -0.659 . . . . 0.0 113.048 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -77.05 152.58 35.03 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 117.007 0.404 . . . . 0.0 110.949 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -115.54 144.7 43.49 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.4 144.85 46.78 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.925 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.4 mt -115.51 120.28 64.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.18 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 31.3 mt -141.62 126.58 17.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.238 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.51 135.24 33.99 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.162 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -127.02 128.37 46.23 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.051 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.9 p -87.1 123.06 31.75 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.669 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -64.91 154.08 86.96 Favored Pre-proline 0 C--O 1.233 0.232 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.264 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.39 127.34 14.79 Favored 'Cis proline' 0 C--N 1.35 0.616 0 C-N-CA 123.343 -1.524 . . . . 0.0 112.733 0.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.9 p -84.26 122.83 38.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.887 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.55 142.69 29.83 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.079 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -60.39 -42.41 95.84 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.987 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.412 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 16.2 mt-10 -61.56 -39.41 91.01 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.954 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -68.75 -44.28 74.07 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.015 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 29.1 t -62.22 -48.02 90.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.838 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.412 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 10.8 pt-20 -63.78 -34.79 78.68 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.261 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.2 -48.38 80.51 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.047 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -63.48 -40.59 97.5 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.743 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.97 -44.19 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.314 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 m -65.23 -38.88 91.75 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.965 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 m -71.55 -47.35 55.65 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.5 p -59.92 -48.8 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -84.01 -18.11 38.22 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.47 28.47 69.53 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.711 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -162.49 156.32 17.88 Favored Pre-proline 0 CA--C 1.529 0.158 0 CA-C-N 116.725 0.263 . . . . 0.0 110.922 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.04 107.12 2.29 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.664 2.243 . . . . 0.0 112.526 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.407 ' CD2' ' HB3' ' A' ' 79' ' ' LEU . 6.1 mp -108.65 126.44 52.98 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.029 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.44 135.4 39.41 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.842 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 73.5 mt -83.18 95.59 8.16 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.932 0.396 . . . . 0.0 110.536 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 -87.56 118.01 26.75 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.188 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -107.52 118.63 37.23 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.447 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.4 mmm -117.61 131.65 56.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.06 -48.74 7.83 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.586 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -173.15 -62.66 0.02 OUTLIER 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.482 179.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -111.29 -25.29 9.75 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.81 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -101.38 132.22 47.07 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 111.261 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -97.81 127.62 43.88 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.988 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.0 mt -118.11 131.51 70.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.011 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.4 tt -101.31 121.74 42.44 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.807 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 43.9 mt -79.14 100.64 7.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.65 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.52 -34.99 11.84 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.118 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -141.61 178.52 7.41 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.901 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -32.79 73.65 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.268 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.1 -47.68 71.52 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.648 0.261 . . . . 0.0 111.145 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -65.59 -46.2 80.31 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.0 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 10.3 tp -62.71 -42.46 99.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.146 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.24 -36.38 81.53 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.066 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.86 -36.48 83.4 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.651 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.22 -36.42 84.1 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.113 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 25.8 mm -64.56 -46.07 93.68 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.903 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.81 -40.25 69.34 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.267 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 11.7 mt -68.35 -45.63 82.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.893 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.3 tp -66.6 -42.62 86.61 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.027 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.85 -42.65 84.9 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.111 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -69.81 -30.4 67.92 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.925 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.5 t -69.2 146.69 52.18 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.817 0.342 . . . . 0.0 111.147 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.4 m -75.84 -20.83 57.82 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.617 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 76.1 p -94.43 38.69 1.09 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.792 0.329 . . . . 0.0 111.426 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.38 120.64 24.09 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.594 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.35 -68.18 0.19 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.963 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.31 173.19 8.54 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.872 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.3 mp -109.24 125.76 52.6 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.12 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 26.9 ttt180 -86.7 107.33 18.17 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.708 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.9 mt -129.7 131.89 66.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.963 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.4 mt -102.03 127.64 48.82 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.817 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 40' ' ' LEU . 40.0 mt -93.74 119.67 33.02 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.101 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mp -144.95 144.89 31.3 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.917 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -80.25 100.01 8.12 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.82 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -105.36 34.96 3.01 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.629 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -130.01 94.08 3.63 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.892 0.377 . . . . 0.0 110.78 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -126.97 -38.58 2.01 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.155 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -96.25 34.03 1.66 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.662 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -174.24 146.75 1.14 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.409 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -156.95 37.27 0.3 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.148 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -161.66 160.74 29.02 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.65 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.04 47.21 7.54 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.093 0.473 . . . . 0.0 110.702 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -70.69 -177.23 1.49 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.147 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -78.25 61.49 2.73 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.928 0.394 . . . . 0.0 110.705 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 58.3 87.67 0.07 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.375 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 4.2 p80 . . . . . 0 C--O 1.252 1.219 0 CA-C-O 118.72 -0.657 . . . . 0.0 111.221 179.679 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.842 0.353 . . . . 0.0 111.49 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 8.1 t -94.14 179.27 5.37 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.549 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.474 ' HB2' ' O ' ' A' ' 2' ' ' SER . 0.8 OUTLIER 71.83 128.28 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.071 -179.865 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.3 t -108.74 139.82 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.205 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.61 113.31 25.38 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.225 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.416 ' HA ' ' HG ' ' A' ' 75' ' ' LEU . 24.0 mt -110.14 123.93 66.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.823 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.0 mttm -95.92 119.94 35.32 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.663 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -106.58 141.26 38.16 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.098 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -120.82 125.75 48.35 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.126 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -140.65 116.75 10.53 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.603 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 57.65 32.92 22.57 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.142 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.77 -14.25 60.63 Favored Glycine 0 CA--C 1.525 0.711 0 C-N-CA 120.876 -0.678 . . . . 0.0 113.137 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.76 129.02 34.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.963 0.382 . . . . 0.0 110.859 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.61 135.01 45.02 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.949 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -139.51 143.95 37.7 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.8 mp -116.37 121.25 67.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.94 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.2 mm -123.4 136.35 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.347 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -100.22 134.12 43.62 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.011 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -128.0 125.87 40.25 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.091 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.2 t -85.56 150.97 24.28 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.97 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -86.62 150.78 51.77 Favored Pre-proline 0 CA--C 1.529 0.173 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.428 179.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.09 127.22 14.61 Favored 'Cis proline' 0 C--N 1.349 0.582 0 C-N-CA 123.573 -1.428 . . . . 0.0 112.752 0.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.5 p -93.07 129.88 42.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.057 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.59 143.63 30.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.104 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -57.36 -52.58 64.79 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.872 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.03 -35.27 74.73 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.036 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -62.39 -44.77 95.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.719 0.295 . . . . 0.0 110.987 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 39.6 t -67.69 -48.43 76.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.52 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -62.75 -36.84 84.36 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.46 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -57.69 -45.03 86.18 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.026 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.13 -46.48 90.41 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.776 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 33.8 t -61.65 -47.45 93.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.208 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 m -65.69 -38.74 90.09 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.388 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.0 m -71.5 -48.48 48.7 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 111.55 0.204 . . . . 0.0 111.55 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.39 -50.06 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.474 0.178 . . . . 0.0 111.36 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -80.74 -20.13 43.43 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.47 34.41 73.85 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.802 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.434 ' OE1' ' HB3' ' A' ' 81' ' ' SER . 1.1 pt20 -167.6 149.65 5.33 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.73 0.265 . . . . 0.0 111.238 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.65 126.84 8.44 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.76 2.307 . . . . 0.0 112.709 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.4 mp -133.79 144.51 49.07 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.919 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.34 130.17 37.23 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.636 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.403 ' HB2' ' HB2' ' A' ' 53' ' ' LEU . 1.1 mp -81.6 116.74 21.5 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.083 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -102.03 121.26 41.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.186 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.502 ' CZ ' ' HB1' ' A' ' 62' ' ' ALA . 0.5 OUTLIER -94.62 128.78 41.5 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.794 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.2 ptt? -131.59 114.56 14.99 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.742 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -90.57 -66.01 0.96 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.718 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -146.04 -70.42 0.26 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.409 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -112.46 -16.0 12.98 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.62 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -110.7 139.78 45.67 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.802 0.334 . . . . 0.0 111.253 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.1 m -120.77 124.68 45.71 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.598 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.9 mt -114.96 134.44 58.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.024 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 tt -92.0 129.37 37.97 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.185 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.403 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 8.2 mt -82.36 90.44 6.68 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.058 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -106.74 -33.67 7.53 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.158 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.05 167.08 11.47 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.062 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.36 -37.07 85.92 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.061 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -55.47 -37.59 67.97 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.238 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -65.52 -41.74 92.78 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.672 0.273 . . . . 0.0 110.819 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.79 -42.29 86.21 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.979 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -68.79 -41.64 78.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.009 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -36.49 81.9 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.818 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.502 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -64.83 -40.43 95.18 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.369 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.0 mt -65.06 -41.44 91.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.035 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -53.41 -44.42 68.73 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.173 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 37.5 mt -68.85 -44.2 81.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.05 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.48 -43.41 97.38 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.925 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -60.51 -40.45 91.46 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.36 -32.84 73.21 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.16 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.3 t -89.33 107.63 19.17 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.291 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 12.9 t -70.64 -29.03 65.28 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.672 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 p -60.71 -61.72 2.38 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.0 ttt -76.32 115.76 16.37 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.767 0.318 . . . . 0.0 111.248 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.8 mttm -93.11 -37.02 12.36 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.426 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.7 m -110.72 166.17 11.23 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.625 0.25 . . . . 0.0 111.108 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.416 ' HG ' ' HA ' ' A' ' 6' ' ' ILE . 0.3 OUTLIER -116.86 136.7 52.75 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.107 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 3.5 mtp85 -86.32 116.59 24.58 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.158 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.2 mm -126.65 129.84 71.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.227 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.3 mp -102.15 125.67 48.9 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.607 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.0 mt -98.08 129.44 44.91 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.089 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -149.62 135.41 18.65 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.253 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.434 ' HB3' ' OE1' ' A' ' 38' ' ' GLN . 81.6 p -85.69 131.07 34.4 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.456 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.55 35.87 1.74 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.732 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -157.37 85.74 0.93 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.046 0.45 . . . . 0.0 111.062 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.45 -5.96 45.56 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.607 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -66.27 81.69 0.09 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.084 0.469 . . . . 0.0 111.288 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -173.93 169.9 3.98 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.175 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -121.65 143.08 49.53 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.943 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -107.18 -34.73 7.04 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.019 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.71 -177.19 0.18 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 120.702 0.287 . . . . 0.0 111.19 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -80.83 92.6 6.12 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.914 0.388 . . . . 0.0 110.538 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.51 -179.62 3.87 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.28 -179.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -104.81 142.7 34.26 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.208 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.553 -0.737 . . . . 0.0 111.084 179.636 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 120.639 0.257 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.4 p -169.52 78.93 0.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.42 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -162.83 104.25 1.03 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.143 -179.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -98.93 131.66 45.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.034 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -90.16 105.56 17.89 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.893 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -111.15 135.13 51.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.056 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -104.25 121.23 42.87 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.698 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 0.427 ' O ' ' HA ' ' A' ' 14' ' ' ARG . 11.3 m-85 -99.85 142.24 31.59 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.084 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -131.69 125.54 32.33 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -148.86 117.67 6.66 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.686 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 58.0 31.47 20.68 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.456 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.87 -14.44 58.62 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.087 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -85.08 106.98 16.95 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 117.013 0.406 . . . . 0.0 110.378 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.427 ' HA ' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -101.21 144.07 30.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.013 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -143.01 157.94 44.07 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.364 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.8 mp -115.98 123.07 70.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.821 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 30.9 mt -130.86 138.63 53.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.181 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.24 133.97 34.59 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.125 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -128.13 117.63 21.96 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 97.6 p -76.21 145.89 39.46 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.126 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -98.91 154.52 37.32 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.032 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.34 120.71 7.14 Favored 'Cis proline' 0 C--N 1.351 0.704 0 C-N-CA 123.335 -1.527 . . . . 0.0 112.796 0.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -75.57 129.46 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.266 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.73 139.29 33.82 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.973 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -55.31 -44.25 75.62 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.765 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.71 -41.15 94.66 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.924 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.4 -44.44 96.43 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.116 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.2 t -65.88 -48.63 81.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.823 179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -58.44 -39.97 81.3 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.241 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -40.24 80.25 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.754 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.54 -48.13 65.11 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.993 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 23.2 t -60.02 -42.62 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.344 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.6 m -61.37 -39.0 89.04 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.924 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.9 m -71.49 -46.98 58.34 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 111.47 0.174 . . . . 0.0 111.47 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 36.8 t -58.27 -50.05 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -83.6 -24.67 31.39 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.17 28.25 58.59 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.848 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.418 ' HB2' ' HD2' ' A' ' 39' ' ' PRO . 1.5 pt20 -173.08 159.63 3.49 Favored Pre-proline 0 N--CA 1.464 0.226 0 CA-C-N 116.712 0.256 . . . . 0.0 110.973 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.418 ' HD2' ' HB2' ' A' ' 38' ' ' GLN . 56.3 Cg_endo -71.23 109.73 2.66 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.631 2.221 . . . . 0.0 112.524 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.9 mp -115.59 154.82 28.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.091 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -98.17 141.9 30.52 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.779 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.49 100.06 9.38 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.695 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.0 m170 -92.14 131.04 37.7 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.418 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -107.03 121.94 45.46 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.486 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 7.7 mmt -109.32 114.75 28.69 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.62 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -72.3 -56.58 5.26 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.734 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -170.77 -58.6 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.574 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -117.44 2.57 12.45 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.676 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -131.76 159.59 38.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.784 0.326 . . . . 0.0 111.659 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.87 125.08 49.84 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.262 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 28.0 mm -116.14 132.11 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.851 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -96.33 126.82 41.8 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.817 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.0 mt -87.56 92.11 8.98 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.761 0.315 . . . . 0.0 110.764 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.9 pttt -107.46 -34.38 7.07 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.416 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -131.54 171.04 13.9 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.712 0.291 . . . . 0.0 111.033 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -31.54 71.19 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.922 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -54.09 -44.77 71.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.664 0.269 . . . . 0.0 111.029 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -67.21 -36.76 82.4 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.809 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.3 tp -68.86 -41.85 77.87 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.095 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.58 -41.1 96.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.066 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -62.99 -39.21 94.07 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.847 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.3 -43.67 97.17 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.078 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 43.9 mm -65.37 -41.49 91.34 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.826 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.48 -43.26 75.38 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.971 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.0 mt -67.83 -42.44 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.881 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.9 tp -67.36 -39.23 85.69 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.399 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.57 -37.51 86.45 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.695 0.283 . . . . 0.0 110.924 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -32.37 62.78 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.511 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.3 p -78.48 119.45 21.8 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.03 0.443 . . . . 0.0 111.162 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.49 -29.5 56.85 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.674 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.1 p -93.67 34.58 1.18 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 120.634 0.254 . . . . 0.0 111.678 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.5 mtm -149.98 123.21 8.93 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.667 0.27 . . . . 0.0 111.022 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.55 -46.97 2.35 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.684 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.1 t -83.65 174.09 10.81 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.951 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mp -119.07 135.29 54.72 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.903 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.9 mtt85 -102.0 107.49 18.63 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.727 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 9.0 mt -129.58 131.79 66.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.868 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.07 119.48 38.86 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.604 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.6 mt -93.42 129.44 39.57 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.116 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mp -138.58 134.95 34.47 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.086 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.13 161.39 30.95 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.96 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 64.11 75.87 0.37 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.682 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -71.99 179.83 3.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.372 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 60.34 72.24 0.53 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.117 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.09 119.73 30.68 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.957 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.64 147.84 50.51 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.324 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.3 -35.27 67.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.117 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -118.69 60.49 0.8 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.826 0.346 . . . . 0.0 111.11 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -63.39 -56.86 12.82 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.658 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 65.62 106.04 0.04 OUTLIER 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.862 179.418 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -160.86 156.89 25.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.557 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -162.22 142.16 9.86 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.811 179.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 24.0 m80 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.043 -0.98 . . . . 0.0 111.36 -179.717 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 120.499 0.19 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 65.26 172.39 0.21 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.363 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 58.41 95.03 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.126 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -75.46 143.68 12.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.075 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.4 mtp85 -95.36 114.65 26.44 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.769 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 mp -115.4 134.74 57.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.269 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.69 127.47 47.09 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.785 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -107.46 138.46 43.63 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.059 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -130.47 124.18 31.41 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.105 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.423 ' CD2' ' HB2' ' A' ' 79' ' ' LEU . 1.9 t-160 -147.06 127.91 14.42 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.633 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.08 27.68 16.71 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.489 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.45 -13.98 60.78 Favored Glycine 0 CA--C 1.526 0.728 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.13 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -83.04 163.44 20.96 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 117.004 0.402 . . . . 0.0 111.119 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.1 mtt180 -120.65 153.03 37.42 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.251 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.1 141.15 28.55 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.02 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mt -111.73 119.02 59.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.877 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.16 130.34 34.24 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 120.925 0.393 . . . . 0.0 111.218 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.57 135.68 40.62 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.055 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -122.93 126.65 47.65 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.11 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.3 m -72.63 138.56 46.81 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.015 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.26 152.68 38.71 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.964 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.2 132.31 26.89 Favored 'Cis proline' 0 C--N 1.349 0.594 0 C-N-CA 123.275 -1.552 . . . . 0.0 112.726 0.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -110.65 130.45 63.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.118 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.71 144.91 25.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.014 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -54.71 -37.4 65.81 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.193 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -59.35 -45.07 92.41 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.046 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.47 -44.21 95.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.105 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.4 t -65.43 -48.82 81.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.891 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -56.68 -41.42 77.29 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.839 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -57.67 -42.32 83.33 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.737 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.8 -47.64 71.47 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.131 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.53 -45.65 86.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.138 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.9 m -62.66 -38.78 91.67 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.087 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.3 m -71.48 -46.91 58.59 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.3 t -60.68 -49.92 82.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -83.84 -21.96 31.87 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.54 -16.74 60.09 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 120.735 -0.745 . . . . 0.0 113.06 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -146.11 158.0 49.0 Favored Pre-proline 0 CA--C 1.531 0.227 0 CA-C-N 116.846 0.323 . . . . 0.0 110.758 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.99 129.61 14.46 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.573 2.182 . . . . 0.0 112.489 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.7 mp -120.86 151.91 39.06 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.36 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.24 137.64 32.17 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.611 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.429 ' HB2' ' HB2' ' A' ' 53' ' ' LEU . 3.1 mt -98.76 107.03 19.37 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.942 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -93.75 114.89 27.27 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.048 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -95.12 129.07 42.36 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 21.8 ptm -127.11 121.63 31.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.712 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -86.34 -60.05 2.11 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.358 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -154.12 -67.97 0.14 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.273 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.59 -21.39 12.15 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.683 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mp -104.65 140.38 38.12 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.768 0.318 . . . . 0.0 111.311 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.91 122.36 46.75 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.827 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.5 mt -113.95 132.52 62.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.83 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 31.2 tp -93.3 134.84 35.1 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.759 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.429 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 56.1 mt -87.37 107.57 18.59 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.997 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.57 -35.72 6.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.306 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -136.87 180.0 6.04 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.39 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -64.32 -34.33 77.88 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.122 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.04 -40.35 73.36 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.796 -0.183 . . . . 0.0 111.283 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -66.36 -50.02 64.96 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.422 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.9 pp -69.79 -34.38 73.65 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.968 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -61.31 -43.76 98.33 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.62 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -70.22 -32.75 70.77 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.07 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.81 -39.32 93.94 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.319 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 5.8 mt -61.08 -47.37 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.736 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -53.18 -37.32 61.81 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.157 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.0 mt -64.91 -38.38 82.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.067 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 14.5 mt -66.55 -46.99 74.26 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.984 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.12 -38.16 85.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.199 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -28.74 67.91 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.47 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.1 p -62.44 165.83 5.74 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.956 0.407 . . . . 0.0 111.519 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.88 -43.16 18.56 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.198 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 57.6 p -127.62 -35.06 2.16 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -50.45 91.45 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.181 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -106.73 -32.35 8.02 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.168 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.6 p -69.12 -179.85 1.68 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.63 0.252 . . . . 0.0 111.09 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mp -129.69 117.64 20.65 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.723 0.297 . . . . 0.0 111.525 -179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -86.89 106.89 18.08 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.246 179.356 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.6 mt -129.78 130.8 66.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.111 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -103.9 129.61 51.44 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.578 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.423 ' HB2' ' CD2' ' A' ' 10' ' ' HIS . 4.9 mt -93.63 129.11 40.02 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.25 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.8 mp -138.3 134.08 33.86 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.072 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.7 m -63.18 115.42 4.48 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.297 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -112.66 33.36 5.02 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.305 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.87 54.45 2.43 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.035 0.445 . . . . 0.0 110.871 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -117.19 -42.59 2.9 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.007 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -86.02 111.43 20.29 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.106 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.1 mt -107.44 -39.6 5.6 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.29 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 67.41 101.96 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.671 0.388 . . . . 0.0 111.602 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.432 ' O ' ' HB2' ' A' ' 89' ' ' HIS . 0.1 OUTLIER -107.56 -173.88 2.39 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.17 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.432 ' HB2' ' O ' ' A' ' 88' ' ' HIS . 39.8 m-70 70.4 175.54 0.29 Allowed 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 13.8 p80 -59.36 -31.34 69.12 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.11 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.68 127.0 29.33 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.121 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 63.75 89.45 0.09 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.355 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 12.3 t-160 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.164 -0.922 . . . . 0.0 110.755 179.987 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 120.551 0.215 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 m -164.39 81.85 0.4 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.784 0.326 . . . . 0.0 111.162 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -170.94 114.89 0.43 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.772 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.28 138.99 52.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.148 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.61 113.73 25.22 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.031 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 21.3 mt -104.93 117.44 50.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.974 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -98.41 127.16 44.22 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.022 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -110.71 147.87 33.48 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.025 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -129.56 132.76 46.91 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.223 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . 0.414 ' HB2' HD12 ' A' ' 79' ' ' LEU . 12.3 t-80 -148.19 112.97 5.41 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.812 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 56.39 36.74 28.02 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.396 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.43 -13.96 62.42 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.218 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -84.34 122.01 28.33 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.984 0.392 . . . . 0.0 110.812 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -105.38 146.03 29.99 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.135 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.57 138.51 24.76 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.136 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.2 mp -105.75 122.1 58.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.999 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.1 mt -126.27 127.45 70.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.923 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.3 140.76 29.38 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.315 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -137.35 119.85 15.97 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.76 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.0 m -75.63 134.62 40.59 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.081 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.3 mtm180 -75.77 150.42 83.98 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.226 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.06 120.76 7.33 Favored 'Cis proline' 0 C--N 1.349 0.577 0 C-N-CA 123.284 -1.549 . . . . 0.0 112.283 -0.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.6 p -73.77 127.66 35.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.983 0.42 . . . . 0.0 110.993 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.97 130.57 46.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.945 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -55.87 -35.99 67.09 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.997 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.19 -44.49 96.49 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.152 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -66.26 -44.8 82.63 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.703 0.287 . . . . 0.0 111.006 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.1 t -67.16 -46.51 84.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.95 179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -61.4 -42.51 98.84 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.304 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -58.16 -41.87 84.73 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.011 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -46.98 88.31 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.881 179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.0 t -66.25 -45.55 89.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.12 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.1 m -60.09 -38.71 83.74 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.1 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 59.7 m -70.61 -43.58 69.02 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.1 t -58.47 -49.87 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-O 120.526 0.203 . . . . 0.0 111.311 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.455 ' CE2' HD13 ' A' ' 79' ' ' LEU . 77.7 m-85 -83.7 -28.13 28.51 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.04 28.49 34.1 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.668 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -168.94 158.4 7.72 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-O 120.535 0.207 . . . . 0.0 110.899 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.03 124.7 10.79 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.943 2.429 . . . . 0.0 112.217 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.416 HD13 ' CD2' ' A' ' 36' ' ' PHE . 4.0 mp -117.21 151.54 36.68 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.175 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.25 120.99 40.75 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.928 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mp -83.52 125.88 32.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.13 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -113.67 115.57 28.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -111.67 121.85 46.22 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.696 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -115.52 133.27 56.19 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.757 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -74.17 -56.18 5.21 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.77 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -170.04 -57.57 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.39 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.64 -30.32 10.04 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.316 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.6 mt -108.89 145.31 35.57 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.968 0.413 . . . . 0.0 111.389 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 30.2 t -109.78 127.98 55.0 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.952 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.9 mt -118.42 134.44 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.978 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.1 tt -90.69 128.98 36.83 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.841 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 47.5 mt -81.33 96.96 7.48 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.962 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -108.72 -37.85 5.79 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.226 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -125.96 175.81 7.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.099 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -62.97 -32.63 74.01 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.904 179.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.25 -39.12 72.07 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.353 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -64.16 -50.43 68.2 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.495 -179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 pp -71.75 -34.45 69.51 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.086 -0.246 . . . . 0.0 110.926 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -63.01 -43.25 99.29 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.786 0.326 . . . . 0.0 111.027 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -33.26 73.71 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.91 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.96 99.69 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.257 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 16.0 mt -63.88 -42.58 96.31 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.737 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -54.35 -41.83 69.55 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.872 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 29.2 mt -66.7 -41.04 87.48 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.983 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.412 HD13 ' HG ' ' A' ' 75' ' ' LEU . 6.0 mt -65.19 -40.32 94.07 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.113 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -66.75 -32.02 73.04 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.171 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -33.77 76.57 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.48 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.7 t -104.76 134.22 48.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.452 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 94.3 p -77.33 -37.29 52.76 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.989 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.5 p -63.27 -35.85 81.7 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.135 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.07 121.49 27.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.698 0.285 . . . . 0.0 111.068 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -132.17 -52.61 0.96 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.996 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.2 m -70.01 177.94 2.95 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.134 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.412 ' HG ' HD13 ' A' ' 66' ' ' LEU . 1.1 mp -131.9 119.03 20.61 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.157 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -96.65 107.02 19.39 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.32 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.5 mt -128.69 132.19 67.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.904 -179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.6 mp -102.08 130.72 48.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.626 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.455 HD13 ' CE2' ' A' ' 36' ' ' PHE . 2.0 pp -117.86 136.05 53.7 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.958 0.409 . . . . 0.0 111.215 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mp -137.74 158.45 44.34 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.944 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.9 t -59.02 110.34 1.02 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.099 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -109.99 39.15 2.21 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.167 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -106.99 32.82 4.31 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.711 0.291 . . . . 0.0 110.933 179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 65.04 21.9 12.32 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.312 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 71.48 141.82 0.05 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.99 0.424 . . . . 0.0 111.623 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.0 tp -139.38 37.74 2.07 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.395 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 51.56 75.48 0.2 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.632 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -138.46 80.46 1.79 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 0.0 110.922 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 30.6 m80 -122.82 -49.51 1.98 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.883 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 33.6 p-80 -161.85 89.61 0.74 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.932 0.396 . . . . 0.0 111.386 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -165.45 126.72 1.96 Allowed 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.157 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 46.2 m80 -83.73 -180.0 7.45 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.719 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.115 -0.945 . . . . 0.0 111.444 -179.764 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 120.831 0.348 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.45 179.94 5.28 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.812 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 68.56 101.5 0.05 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.236 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 22.2 t -101.56 129.33 52.88 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.783 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -90.6 105.58 17.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.056 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.99 129.07 71.8 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.208 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.4 mtpt -100.34 126.81 46.73 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.634 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -114.89 127.56 55.77 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.022 -179.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -122.0 131.2 53.87 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.217 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -145.5 128.73 16.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.694 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.73 30.67 20.25 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.221 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.96 -13.96 59.95 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.982 -0.628 . . . . 0.0 113.065 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.33 116.57 28.4 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 117.001 0.401 . . . . 0.0 110.848 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -104.93 135.87 45.48 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.233 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -134.2 154.27 51.35 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.248 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 7.4 mt -115.31 122.25 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.344 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.4 mm -127.49 128.66 70.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.145 179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.91 129.05 36.32 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.694 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -117.34 117.61 29.99 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.386 -179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.02 157.14 38.07 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.173 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.9 mmt180 -99.84 151.31 37.44 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.469 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.35 145.11 81.25 Favored 'Cis proline' 0 C--N 1.35 0.608 0 C-N-CA 123.414 -1.494 . . . . 0.0 112.801 0.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.6 p -107.42 124.49 63.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.106 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.7 mmtm -102.56 149.88 23.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.236 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -58.11 -48.17 81.03 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.757 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.35 -42.28 95.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.227 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -62.08 -44.33 96.9 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.059 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 38.3 t -68.83 -48.72 69.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.785 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -40.06 84.62 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.2 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -58.18 -39.89 80.07 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.816 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -70.97 -41.03 71.57 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.752 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 37.8 t -66.64 -42.58 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.186 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 t -65.71 -38.5 89.36 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.146 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.9 m -71.31 -46.79 59.85 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 13.4 p -60.38 -47.95 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 -179.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -84.08 -18.09 38.08 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.43 22.63 64.46 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 120.865 -0.683 . . . . 0.0 113.118 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -172.26 149.87 2.22 Favored Pre-proline 0 N--CA 1.463 0.216 0 CA-C-N 116.863 0.331 . . . . 0.0 110.94 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -74.23 106.9 2.32 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.569 2.179 . . . . 0.0 112.125 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mp -104.87 140.04 38.73 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.96 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.47 140.75 41.36 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.017 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.3 mp -101.95 118.52 37.08 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.062 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -105.3 129.69 53.59 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.299 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -109.79 129.01 55.67 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.656 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.1 mtt -125.48 132.41 52.66 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.682 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -97.61 -65.83 0.94 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.686 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -144.87 -71.51 0.27 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.442 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -111.58 -18.23 12.86 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.527 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.3 mp -105.63 139.96 39.43 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.803 0.335 . . . . 0.0 111.35 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.8 m -114.03 125.8 54.4 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.828 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.1 mt -114.0 132.54 62.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.099 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.6 tt -92.38 128.08 38.1 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.8 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 71.9 mt -71.51 100.03 2.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.564 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -90.2 -49.25 6.66 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.424 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -149.06 -170.2 3.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.869 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.69 -32.34 65.34 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.255 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -53.76 -45.66 70.69 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.849 0.357 . . . . 0.0 110.799 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.03 -42.69 84.43 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.166 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 77.5 mt -67.82 -40.53 83.78 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.272 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -61.66 -43.46 98.81 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.06 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -63.39 -39.4 94.41 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.388 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.64 98.93 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.188 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 6.2 mt -63.78 -45.73 96.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.883 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -44.85 78.32 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.041 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.3 mt -67.09 -39.48 83.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.989 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 9.4 tp -61.99 -45.45 93.59 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.057 179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -56.92 -37.24 71.2 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.256 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -33.24 64.62 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.101 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.3 t -89.07 92.68 9.31 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.256 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 40.6 t -62.99 -34.75 78.2 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.054 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.06 -33.78 67.6 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.318 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.96 129.42 42.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.097 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 47.5 mttt -111.71 -44.69 3.45 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.887 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 60.5 p -101.62 179.04 4.46 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.187 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -123.25 128.93 50.68 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.062 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -88.47 108.57 19.45 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.654 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.9 mt -127.26 131.3 70.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.189 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -102.02 128.29 48.52 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.699 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.5 mt -94.02 122.35 36.43 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.148 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.1 mp -134.1 134.24 42.04 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.114 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m -68.64 124.18 22.91 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.996 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -143.76 62.63 1.36 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.068 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -99.65 44.94 1.0 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.765 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -102.73 32.09 3.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.852 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -157.23 172.14 19.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.719 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.2 mp -97.24 -82.12 0.41 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.852 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 173.94 -176.53 0.08 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 122.321 0.248 . . . . 0.0 110.496 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -116.42 93.99 4.45 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.797 0.332 . . . . 0.0 110.944 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.04 135.57 17.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.239 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -172.42 96.65 0.15 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.225 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -97.39 -38.26 9.69 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.105 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -117.38 -67.03 1.02 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.905 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.3 t60 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.897 -179.949 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 120.691 0.282 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m -106.32 131.05 54.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.068 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 68.41 110.57 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.673 0.608 . . . . 0.0 111.342 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.4 t -99.59 131.58 46.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.208 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -88.96 119.93 29.92 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.746 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.5 mt -115.66 133.63 61.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.192 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.8 mttp -99.43 125.0 45.07 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.834 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -114.11 137.22 52.02 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.182 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.48 133.36 55.42 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.392 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -146.13 116.8 7.62 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.265 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 57.97 33.99 23.8 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.391 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.24 13.31 80.98 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 121.029 -0.605 . . . . 0.0 113.348 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -109.49 120.36 42.27 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 117.237 0.519 . . . . 0.0 110.518 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -92.75 135.21 34.31 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.978 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.38 143.39 50.74 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.036 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.6 mt -110.12 116.02 51.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.199 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 26.3 mm -128.36 131.46 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.046 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.47 129.88 36.59 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.007 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -127.15 118.38 24.23 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.934 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.95 145.08 34.21 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.972 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -99.85 149.56 36.06 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.171 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.77 121.65 7.95 Favored 'Cis proline' 0 C--N 1.35 0.655 0 C-N-CA 123.361 -1.516 . . . . 0.0 112.899 0.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.7 p -89.86 130.48 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.855 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -84.09 138.25 33.14 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.126 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -55.99 -45.04 79.13 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.234 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.57 -39.62 80.82 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.938 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -63.4 -44.59 94.24 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.047 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t -67.87 -48.88 73.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.016 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -41.18 96.08 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.503 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -45.39 87.38 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.766 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.4 tptm -61.59 -47.58 84.84 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.769 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.1 t -58.93 -48.9 84.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-O 120.668 0.271 . . . . 0.0 110.964 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.4 m -64.28 -39.03 93.11 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.472 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.3 m -71.82 -48.19 48.01 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.85 -48.83 87.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 -179.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -83.28 -22.09 33.11 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.67 -7.73 81.13 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.887 -0.673 . . . . 0.0 113.34 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -131.67 145.57 58.09 Favored Pre-proline 0 CA--C 1.529 0.152 0 CA-C-N 117.279 0.539 . . . . 0.0 110.984 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -75.06 94.4 0.96 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.57 2.18 . . . . 0.0 112.211 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.6 mp -94.68 135.98 35.52 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.888 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.16 140.47 41.75 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.962 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 mt -87.3 100.19 12.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.596 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -95.44 117.76 30.95 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.497 -179.382 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -107.07 115.94 31.06 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.361 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.4 ptm -101.3 134.88 43.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.77 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -89.62 -45.46 9.34 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.87 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -173.16 -68.36 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.43 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -108.99 -24.5 11.18 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.505 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 mp -105.03 137.94 42.0 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.789 0.328 . . . . 0.0 111.302 -179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 p -95.62 124.42 39.64 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.596 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.7 134.37 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.735 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 14.0 tp -102.74 130.84 49.82 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.743 0.306 . . . . 0.0 110.957 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 8.1 mt -78.07 93.35 4.49 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.852 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.15 -37.46 12.1 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.155 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -134.83 171.55 14.22 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.835 0.35 . . . . 0.0 111.337 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.1 tp60 -60.72 -31.61 70.9 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.363 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -52.97 -45.86 67.99 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.773 0.321 . . . . 0.0 110.506 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -63.16 -39.47 94.76 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.239 179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 17.7 tp -66.29 -42.98 87.58 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.143 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.49 -43.12 99.43 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.836 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.66 -40.63 97.68 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.469 179.11 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.42 -42.93 99.81 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.666 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.7 mt -63.3 -44.17 99.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 120.521 0.2 . . . . 0.0 110.834 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -55.79 -43.73 77.1 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.253 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.6 mt -68.87 -41.74 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.933 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tp -60.68 -45.05 95.64 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.012 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -58.62 -41.74 86.63 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.996 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.0 ttp85 -71.29 -33.57 69.84 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.611 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.2 p -82.57 103.03 11.8 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.847 0.356 . . . . 0.0 111.284 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 59.8 m -77.91 -38.2 46.2 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.281 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 p -61.96 -33.22 73.88 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.607 0.241 . . . . 0.0 111.562 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.0 tpt -63.17 150.29 43.27 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.99 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.34 105.25 8.41 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.705 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.9 m 66.04 -178.56 0.19 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.097 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.84 123.42 43.08 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.95 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.33 107.14 18.99 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.835 0.35 . . . . 0.0 110.633 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.6 mt -128.1 131.16 69.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.805 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -102.0 124.65 47.98 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.555 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.5 mt -93.63 133.28 37.13 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.211 -179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -140.21 136.16 33.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.367 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.73 151.84 46.64 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.492 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.33 33.28 5.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.568 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.79 141.69 2.32 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.582 0.23 . . . . 0.0 111.137 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.18 67.32 1.86 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.985 0.422 . . . . 0.0 111.032 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -148.74 78.31 1.4 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.786 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -155.8 42.06 0.41 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.155 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -150.1 -61.13 0.2 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.806 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -87.94 102.49 14.77 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.743 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -156.73 132.04 9.24 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.305 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -109.88 -37.91 5.5 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.256 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -85.93 120.38 27.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.609 0.242 . . . . 0.0 110.795 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -87.17 -179.67 6.49 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.012 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.696 -179.908 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.9 m -158.72 158.21 33.23 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.422 0.153 . . . . 0.0 110.784 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 57.89 87.85 0.06 Allowed 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.222 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -87.18 135.31 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.263 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.2 mtm-85 -92.93 124.5 36.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.913 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.8 mt -113.62 136.79 48.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.151 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -95.65 119.74 34.69 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.864 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -107.71 136.69 47.03 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.907 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -127.42 132.1 50.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.826 0.346 . . . . 0.0 111.551 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.7 t-160 -144.58 123.89 13.03 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.55 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 57.5 35.09 25.46 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.062 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 84.01 -14.19 45.06 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.464 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.83 149.26 37.91 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 117.193 0.497 . . . . 0.0 111.198 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -110.44 135.17 51.55 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.058 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -140.8 143.03 34.61 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.739 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.0 mt -118.06 118.13 57.16 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.996 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.4 mp -126.65 127.02 69.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.242 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.9 146.44 23.75 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.118 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -135.27 134.66 40.18 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.064 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -81.72 125.77 31.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.906 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 ptt180 -93.46 153.46 41.37 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.059 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.1 119.62 6.32 Favored 'Cis proline' 0 C--N 1.351 0.703 0 C-N-CA 123.429 -1.488 . . . . 0.0 112.838 0.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -99.88 130.44 48.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.017 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.6 143.12 31.24 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.779 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -57.1 -36.17 70.31 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.926 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -59.18 -44.76 92.17 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.717 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.72 -40.39 95.25 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.9 t -67.8 -49.01 73.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.114 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -59.32 -39.79 84.23 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.927 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -40.71 89.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.823 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.04 -48.21 71.83 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.223 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 44.1 t -59.69 -43.62 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.245 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.6 m -60.66 -38.98 86.66 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.951 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.7 m -71.76 -44.45 64.03 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 111.461 0.171 . . . . 0.0 111.461 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 34.5 t -59.52 -50.18 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-O 120.49 0.186 . . . . 0.0 111.444 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -83.71 -26.57 29.67 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.24 -11.13 61.84 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.926 -0.654 . . . . 0.0 113.145 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -141.54 156.96 66.46 Favored Pre-proline 0 N--CA 1.465 0.283 0 CA-C-N 116.978 0.389 . . . . 0.0 110.702 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.16 111.68 3.13 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.586 2.191 . . . . 0.0 112.524 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.4 mp -101.68 157.92 16.48 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -99.89 138.05 37.5 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.968 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 mp -91.79 112.63 24.63 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.994 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -103.05 111.81 24.34 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.117 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -104.35 117.44 34.19 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.591 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 6.4 mtp -123.49 126.53 46.9 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.824 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -74.0 -59.59 2.65 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.43 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -170.22 -54.75 0.02 OUTLIER 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.431 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -104.32 -31.82 9.37 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.498 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.5 mp -108.76 144.25 36.83 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.79 0.328 . . . . 0.0 111.329 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.2 m -113.59 123.48 50.07 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.994 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -114.53 133.35 60.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.916 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.0 tt -93.65 124.73 37.84 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.982 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.434 HD21 ' HB3' ' A' ' 58' ' ' ASP . 4.2 mt -75.89 94.44 3.35 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.454 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -85.47 -34.31 21.65 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.416 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -160.51 -169.83 2.58 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.776 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -61.2 -29.82 70.04 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.493 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.95 -47.08 68.37 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.795 0.331 . . . . 0.0 110.725 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.434 ' HB3' HD21 ' A' ' 53' ' ' LEU . 1.7 t70 -67.64 -40.47 84.59 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.004 179.441 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 tp -66.8 -37.47 84.61 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.277 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -61.18 -42.79 99.19 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.12 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.92 -35.64 80.46 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.613 179.4 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -37.36 86.84 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.055 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 7.9 mt -63.83 -40.76 90.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.956 179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -53.31 -45.39 68.96 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.864 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.7 mt -69.04 -36.38 73.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.115 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.1 tp -68.91 -41.98 77.48 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.87 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -62.42 -42.39 99.41 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.218 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.2 ptm85 -71.66 -30.46 65.75 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.553 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.7 p -88.99 108.95 19.86 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.892 0.377 . . . . 0.0 111.052 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.2 m -76.07 -34.61 59.57 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.23 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 81.5 p -63.81 -35.0 79.18 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.348 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.8 tpp -84.54 158.67 20.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.959 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.3 tttt -145.6 -54.8 0.29 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.084 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 78.7 p -93.08 173.9 7.5 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.827 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -122.88 131.04 53.57 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.991 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.2 mtm180 -86.55 109.21 18.96 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.984 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 17.4 mm -124.88 132.38 71.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.088 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.5 tp -101.97 131.52 48.33 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.554 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.3 mt -102.19 119.68 39.2 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.051 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.2 mp -141.3 145.39 35.44 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.678 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.4 t -63.58 120.37 11.62 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.951 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -152.98 48.21 0.71 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.28 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -148.42 96.07 2.55 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.241 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.54 43.31 2.93 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.215 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 67.3 169.69 0.25 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.279 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 mp -77.52 -52.34 9.23 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.958 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 53.96 66.91 1.1 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.461 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -90.48 -62.31 1.49 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.014 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 68.0 144.5 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.86 0.362 . . . . 0.0 111.397 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -108.09 98.72 8.24 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.155 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -151.97 97.89 2.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.826 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -98.21 -42.82 7.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.028 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.756 -179.996 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 120.804 0.335 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.2 t -162.28 157.67 23.19 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.88 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -72.39 108.57 5.56 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.597 179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.7 t -99.97 127.37 52.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.959 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.92 121.76 29.85 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.891 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.1 mt -111.61 130.08 65.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.965 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -103.72 113.3 26.72 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.734 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -97.14 143.95 27.45 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.088 -179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -135.59 127.55 29.55 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.197 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -147.85 118.14 7.35 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.552 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 58.74 35.31 24.3 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.095 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.01 6.79 89.22 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 120.949 -0.643 . . . . 0.0 113.249 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -100.59 111.09 23.29 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 117.162 0.481 . . . . 0.0 110.792 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.3 ptt85 -94.64 141.66 28.35 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.197 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.4 mtt85 -143.72 141.24 30.39 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.054 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 21.8 mt -112.62 128.0 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.185 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.113 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.7 mp -134.07 137.82 51.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.226 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.8 135.85 33.45 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.073 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -135.67 116.84 14.44 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.148 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.14 135.24 34.51 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.975 179.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mtt180 -78.55 155.73 78.52 Favored Pre-proline 0 N--CA 1.463 0.193 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.933 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.93 125.56 11.46 Favored 'Cis proline' 0 C--N 1.35 0.64 0 C-N-CA 123.406 -1.498 . . . . 0.0 112.494 -0.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.0 p -108.04 128.5 63.37 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.004 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.4 mttt -92.83 143.22 26.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.166 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -56.48 -39.44 73.23 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.833 179.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -64.73 -39.38 93.54 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.937 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -44.19 96.94 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.935 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t -68.73 -48.04 73.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.051 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -59.99 -40.04 87.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.145 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.48 -39.99 81.49 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.665 179.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 tttt -69.13 -46.56 67.34 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.45 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.0 t -59.76 -48.52 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.399 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -60.77 -38.46 85.33 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.491 -179.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 60.8 m -69.83 -45.39 67.93 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.682 0.252 . . . . 0.0 111.682 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.9 t -60.02 -49.27 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.492 0.186 . . . . 0.0 111.352 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -80.96 -23.6 38.67 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.722 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.2 19.64 76.65 Favored Glycine 0 CA--C 1.523 0.574 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.908 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -155.92 148.36 17.74 Favored Pre-proline 0 C--O 1.233 0.217 0 CA-C-N 116.792 0.296 . . . . 0.0 111.005 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.35 104.29 1.83 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.701 2.267 . . . . 0.0 112.325 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mp -109.23 138.32 45.77 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.059 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -81.22 138.42 35.79 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.064 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.2 mp -90.61 120.66 31.86 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.871 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -108.27 116.76 32.56 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.235 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -110.32 120.36 42.17 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.83 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -130.44 135.58 48.14 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.831 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -77.4 -62.55 1.62 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.863 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.85 -53.69 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.366 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -104.5 -32.46 8.97 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.417 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.49 137.32 44.69 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.692 0.282 . . . . 0.0 111.236 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.7 m -113.82 130.4 56.47 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.841 179.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.4 mt -124.01 133.01 70.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.195 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.2 tt -89.68 131.33 35.71 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.821 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.3 mt -87.58 103.85 15.95 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.896 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -109.12 -36.55 6.03 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.025 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -128.05 174.48 9.18 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.171 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -62.56 -32.48 73.45 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.074 179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -54.12 -41.54 68.45 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.034 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -63.39 -47.5 81.79 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.012 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.06 -40.16 90.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.89 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.05 -42.97 99.75 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.731 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.57 -33.39 74.92 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.961 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.44 -37.21 84.98 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.275 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.8 mt -65.77 -43.91 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.645 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.16 -45.36 91.21 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.079 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 26.3 mt -68.26 -41.42 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.091 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.2 tp -68.74 -39.81 80.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.165 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -62.48 -41.89 99.1 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.653 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.6 ptt180 -67.7 -26.99 66.45 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.622 0.249 . . . . 0.0 110.958 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.1 t -70.34 127.33 32.38 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.716 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.1 m -60.82 -37.08 80.77 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.421 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -65.57 0.66 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.196 -179.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 9.9 ptt? 37.94 66.36 0.48 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.437 0.46 . . . . 0.0 111.846 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm -110.05 89.32 2.99 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.6 m 63.32 170.34 0.15 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.637 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.8 mp -110.33 122.69 48.29 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.102 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.63 107.44 19.43 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.648 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.9 mt -129.67 131.36 66.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.87 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.1 tp -101.9 126.87 48.89 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.617 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.5 mt -93.56 134.38 35.91 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.005 -179.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 pp -150.95 144.09 24.72 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.987 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.2 m -63.02 127.39 31.0 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.124 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -149.18 40.05 0.85 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.816 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -106.72 111.44 23.97 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.855 0.36 . . . . 0.0 111.302 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 64.21 94.93 0.05 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.138 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -98.79 125.94 44.29 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.065 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -135.07 -57.94 0.8 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.789 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.73 168.83 21.09 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.063 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.1 m80 -78.71 125.38 29.3 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.21 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 -82.92 174.88 10.52 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.101 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -135.31 94.09 3.07 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.106 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -130.85 115.56 16.74 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.708 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -105.32 179.74 4.18 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.96 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.049 -0.977 . . . . 0.0 111.39 179.995 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 120.686 0.279 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.4 m -147.08 152.09 37.95 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.262 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 68.81 144.32 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.483 179.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.1 t -139.85 123.51 18.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.204 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.2 108.39 19.27 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.571 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.8 mt -108.43 125.07 65.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.97 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -95.63 120.36 35.73 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.658 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -113.1 127.41 56.19 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.66 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -123.35 139.86 53.6 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.948 0.404 . . . . 0.0 111.429 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -137.89 114.44 10.41 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.451 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 61.22 38.14 16.89 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.125 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.09 -14.33 59.26 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.332 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.41 105.98 17.95 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 117.073 0.436 . . . . 0.0 110.783 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.44 156.23 17.87 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.073 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.1 157.92 43.77 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.046 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.5 mt -114.64 120.29 63.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.7 mt -130.71 126.92 61.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.732 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.09 146.51 24.26 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.212 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -138.46 132.84 31.93 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.049 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 p -81.36 165.9 20.93 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.201 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -110.25 143.87 28.95 Favored Pre-proline 0 CA--C 1.529 0.159 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.13 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.52 136.0 41.27 Favored 'Cis proline' 0 C--N 1.35 0.634 0 C-N-CA 123.362 -1.516 . . . . 0.0 112.576 -0.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.0 p -88.77 129.43 39.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.031 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -100.49 130.71 46.6 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -54.73 -45.26 74.09 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.113 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -58.76 -42.44 88.91 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.049 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -62.88 -44.26 96.57 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.005 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.5 t -64.69 -48.24 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.874 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.09 -36.48 81.83 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.014 179.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -58.36 -36.91 74.18 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.13 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.8 mttt -72.91 -47.92 41.62 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.669 0.271 . . . . 0.0 110.523 179.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.73 -45.43 94.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.264 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -61.67 -38.62 88.43 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.444 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -71.4 -44.29 65.19 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.0 t -60.67 -50.26 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -179.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.484 ' CD2' HD13 ' A' ' 40' ' ' LEU . 77.9 m-85 -83.82 -24.78 30.82 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.53 24.81 32.25 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.913 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -177.43 147.58 0.67 Allowed Pre-proline 0 N--CA 1.465 0.296 0 CA-C-N 116.638 0.219 . . . . 0.0 110.611 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.83 108.4 2.56 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.397 2.065 . . . . 0.0 112.0 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.484 HD13 ' CD2' ' A' ' 36' ' ' PHE . 5.1 mp -89.79 140.8 29.24 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.088 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -75.83 120.34 21.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.013 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.6 mt -86.71 122.9 31.25 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.449 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -112.89 124.4 52.53 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.111 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -108.51 129.01 55.3 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.554 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 6.1 mtt -117.44 127.02 53.61 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.726 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -86.56 -51.93 5.86 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.719 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -173.54 -63.12 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.422 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.61 -27.52 11.3 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.489 179.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.13 153.2 26.06 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.901 0.381 . . . . 0.0 111.31 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.4 t -117.22 128.69 55.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.768 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.8 mm -113.85 133.44 59.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.611 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.8 tt -95.79 130.06 42.83 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.172 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.2 mt -81.95 107.88 15.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.987 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -38.65 4.67 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.408 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -131.67 -179.39 5.35 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.091 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -64.63 -30.19 71.2 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.816 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -57.91 -39.32 77.65 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.583 0.23 . . . . 0.0 110.928 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -68.46 -43.28 77.34 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.832 0.348 . . . . 0.0 110.488 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.56 -44.78 95.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.933 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.23 -41.46 98.43 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.7 mtpm? -66.15 -36.74 83.92 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.217 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.9 -41.48 99.44 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.599 0.238 . . . . 0.0 111.522 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 11.8 mt -66.12 -43.25 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.587 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.9 -42.7 76.41 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.177 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 14.7 mt -66.43 -42.16 89.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.042 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 15.8 tp -59.78 -44.58 93.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.887 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.54 -35.96 70.99 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.902 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.2 ttt-85 -70.61 -35.12 72.82 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.298 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.5 t -86.49 94.19 9.36 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.718 0.294 . . . . 0.0 111.048 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 91.2 p -58.79 -36.98 75.33 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.145 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.2 p -60.35 -33.68 72.76 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.389 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.0 mtt -85.88 123.7 31.53 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.187 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.91 -33.95 7.78 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.233 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -116.65 156.46 27.02 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.583 0.23 . . . . 0.0 110.962 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.88 129.35 37.87 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.662 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.17 107.82 20.42 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.048 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 2.9 mp -128.08 132.16 68.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.956 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.7 tp -102.51 118.29 36.54 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.912 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 pp -110.96 135.41 51.52 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.949 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.1 mp -137.54 148.05 45.64 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.162 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 m -74.98 98.8 3.68 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.696 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -145.19 63.2 1.29 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.817 0.341 . . . . 0.0 110.915 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -108.52 120.42 42.39 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.343 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.46 37.1 2.71 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.603 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -132.56 122.31 24.6 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.143 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 tp -156.79 43.13 0.37 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.91 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -77.63 151.83 34.14 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.124 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -128.68 -54.75 1.23 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.083 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -97.93 30.19 3.14 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.072 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -142.36 113.03 7.33 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.898 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -177.07 -42.4 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.254 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 56.0 t60 76.34 134.83 0.06 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.241 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 15.2 t60 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.42 -0.8 . . . . 0.0 110.891 -179.979 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 120.599 0.238 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.19 169.38 0.22 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.28 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 54.71 85.11 0.06 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.273 -179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.1 t -87.48 127.81 40.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.245 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -98.54 106.87 19.2 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.685 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.0 mp -109.19 133.77 53.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.307 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.82 105.13 13.86 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.546 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -93.17 148.52 21.95 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.15 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -135.7 125.08 24.84 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.982 0.42 . . . . 0.0 111.153 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.2 t-160 -142.16 129.45 21.1 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.514 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.45 29.44 19.01 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.29 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 86.79 -14.1 57.17 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 120.875 -0.679 . . . . 0.0 113.304 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -91.67 132.04 36.64 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 117.078 0.439 . . . . 0.0 110.903 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -101.9 147.7 26.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.184 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -137.1 141.28 42.33 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.969 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.8 mt -111.72 120.76 62.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.125 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.5 mt -133.3 132.74 58.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.141 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.31 141.65 33.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.164 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -123.77 134.94 53.57 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.342 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.6 m -87.47 134.85 33.54 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.142 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.51 149.23 74.81 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.968 179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.22 121.99 8.28 Favored 'Cis proline' 0 C--N 1.35 0.651 0 C-N-CA 123.312 -1.537 . . . . 0.0 112.5 -0.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.0 p -83.04 119.63 32.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.785 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.0 mmmt -98.74 143.79 28.7 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.946 -179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -54.63 -41.41 69.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.001 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.84 -44.48 96.9 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.76 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -62.63 -44.2 96.88 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.259 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.5 t -67.25 -48.4 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.105 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.04 -39.05 77.45 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.811 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -58.92 -45.8 89.49 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.836 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.7 mmtt -61.11 -47.88 84.26 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.946 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.2 t -59.0 -46.83 91.42 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.725 0.298 . . . . 0.0 110.849 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 22.5 m -61.54 -40.16 93.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.287 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 58.9 m -71.73 -46.22 59.28 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.1 t -62.79 -50.1 81.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 121.224 -0.19 . . . . 0.0 111.495 -179.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -83.86 -19.39 34.94 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.88 -20.42 49.95 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.958 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -134.81 147.36 62.65 Favored Pre-proline 0 N--CA 1.462 0.141 0 CA-C-N 116.816 0.308 . . . . 0.0 110.387 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.79 99.25 1.05 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.395 2.063 . . . . 0.0 112.269 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 mp -87.82 156.8 19.22 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.026 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -91.12 140.28 29.97 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.975 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.64 107.47 19.23 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.99 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 113.9 27.7 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.994 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.402 ' CD2' HG12 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -91.68 129.15 37.7 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.219 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -125.35 118.23 25.46 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.951 0.405 . . . . 0.0 110.707 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -88.86 -71.47 0.59 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.049 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -136.19 -72.11 0.45 Allowed 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.37 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -120.9 19.44 11.72 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.127 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.72 147.46 52.51 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.766 0.317 . . . . 0.0 111.134 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.0 p -119.17 126.66 52.09 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.58 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mp -113.62 131.53 65.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.626 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -107.29 121.36 44.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.255 -179.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.6 mt -77.3 95.53 4.38 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.565 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.08 -34.85 11.57 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.134 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -138.24 173.18 11.89 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.847 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -59.26 -34.71 72.57 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.219 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -53.88 -41.14 67.22 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.916 0.389 . . . . 0.0 110.736 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -39.77 94.87 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.011 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 tp -65.35 -43.27 91.39 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.886 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.85 -41.55 97.97 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.797 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -65.21 -36.73 85.1 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.957 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.47 -39.17 92.55 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.499 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 25.4 mt -64.23 -43.18 97.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.751 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.43 -39.27 70.05 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.187 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.8 mt -67.32 -44.62 87.16 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.133 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.63 -47.24 86.38 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.537 -0.302 . . . . 0.0 110.683 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -64.26 -37.39 87.31 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.7 -33.03 74.95 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.2 179.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.1 t -67.02 136.24 54.97 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.83 0.348 . . . . 0.0 111.252 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 18.2 m -74.77 -25.75 59.28 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.501 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.1 t -134.4 82.35 1.96 Allowed 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.06 0.457 . . . . 0.0 110.578 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 30.7 tpp -158.25 105.44 1.91 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.596 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -102.82 -63.15 1.19 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.028 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.8 t -82.0 158.17 23.94 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.181 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.2 mp -101.15 125.22 47.76 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.102 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 107.38 19.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.662 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.402 HG12 ' CD2' ' A' ' 44' ' ' TYR . 22.1 mt -129.44 131.77 67.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.829 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.82 132.32 47.65 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.636 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 10.0 mt -93.66 128.81 40.02 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.174 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.9 mt -133.96 136.24 44.04 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.48 103.08 2.36 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.767 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -123.68 46.08 2.31 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.121 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -98.08 116.05 29.5 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.772 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.52 32.26 2.54 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.483 179.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -163.44 179.26 7.43 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.679 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 mp -115.25 -63.94 1.39 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.927 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -117.83 -46.79 2.63 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.803 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -148.57 138.74 22.43 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.151 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -163.2 -60.97 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.043 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 38.0 t60 -122.45 -61.32 1.48 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.81 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -91.86 143.32 26.63 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.017 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -166.67 87.58 0.32 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.95 0.405 . . . . 0.0 111.379 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 118.488 -0.768 . . . . 0.0 110.656 179.665 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.819 0.343 . . . . 0.0 111.269 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.7 p -147.33 177.48 9.18 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.192 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 66.46 102.13 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.419 0.449 . . . . 0.0 110.974 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.8 t -97.78 135.96 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.328 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.0 114.37 23.55 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.113 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.0 mm -109.06 119.75 59.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.901 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.41 114.46 26.23 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.746 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -100.37 140.32 34.79 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.184 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.72 124.74 20.03 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.124 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -138.89 112.04 7.99 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.575 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 58.46 36.3 25.24 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.353 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.69 -14.27 61.98 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.886 -0.674 . . . . 0.0 113.096 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.8 104.55 11.39 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.957 0.379 . . . . 0.0 110.622 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptp85 -92.3 136.85 32.86 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.189 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.0 ttt85 -137.06 143.53 42.68 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.162 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.93 120.71 61.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.864 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 27.8 mt -134.72 132.55 54.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.168 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.59 143.83 25.94 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.128 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.9 m-85 -129.99 121.14 25.94 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.282 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -76.11 129.41 36.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.838 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -70.25 150.73 95.94 Favored Pre-proline 0 N--CA 1.463 0.212 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.086 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -75.24 134.13 34.52 Favored 'Cis proline' 0 C--N 1.35 0.651 0 C-N-CA 123.705 -1.373 . . . . 0.0 112.472 0.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.6 p -84.12 118.32 31.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-O 120.944 0.402 . . . . 0.0 110.792 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.3 mmtm -101.1 129.94 47.07 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.862 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -55.55 -45.16 77.28 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.952 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -60.1 -42.32 94.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.053 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.49 -44.07 97.27 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.036 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 23.3 t -66.75 -48.0 81.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.577 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.8 -41.59 87.12 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.207 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -57.31 -45.36 84.28 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.877 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 tttm -66.54 -47.83 71.65 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.691 -0.232 . . . . 0.0 110.989 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 45.8 t -58.34 -43.67 86.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.711 0.291 . . . . 0.0 110.982 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 97.2 m -62.84 -38.92 92.7 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.905 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.6 m -71.68 -45.61 61.39 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.384 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.9 t -58.88 -49.69 82.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 120.524 0.202 . . . . 0.0 111.509 -179.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -83.4 -26.91 29.99 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.76 25.54 32.1 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.954 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -169.97 145.67 2.48 Favored Pre-proline 0 N--CA 1.464 0.265 0 CA-C-N 116.871 0.335 . . . . 0.0 110.96 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.52 103.52 1.56 Allowed 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.586 2.191 . . . . 0.0 112.394 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.9 mp -96.26 154.92 16.99 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.107 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -88.72 140.97 28.9 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.997 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.5 mt -100.71 124.05 45.78 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.606 179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -117.0 129.32 55.95 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.162 -179.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -114.32 129.69 56.65 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.763 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.4 mtm -111.31 113.36 25.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.542 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.9 p-10 -67.17 -52.59 39.46 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.282 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -148.84 -73.9 0.18 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.331 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -119.67 14.13 12.58 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.336 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.48 148.72 52.66 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.66 0.267 . . . . 0.0 111.164 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.4 m -112.21 128.76 56.34 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.112 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.7 mp -115.96 132.1 66.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.925 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -81.88 134.31 35.39 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.706 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp -102.65 104.03 14.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.059 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.43 -35.92 6.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.358 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -120.17 170.83 8.95 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.771 0.319 . . . . 0.0 111.051 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.48 -35.51 77.87 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.03 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -55.07 -41.16 71.16 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.069 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -64.03 -47.25 80.97 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.68 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.17 -41.88 99.3 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.149 179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -43.07 99.81 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.01 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -34.07 77.23 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.132 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.57 -35.34 79.19 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.275 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.8 mm -64.24 -44.56 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.627 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -40.88 71.82 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.118 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 37.1 mm -63.34 -45.14 98.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.912 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 tp -62.8 -44.66 95.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.719 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -64.32 -34.7 78.75 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.274 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -32.13 71.73 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.054 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -70.9 154.15 42.07 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.047 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.3 p -76.22 -33.66 59.23 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.362 179.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.7 p -70.66 -76.01 0.11 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.525 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.2 ttt 53.33 82.8 0.07 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.849 0.357 . . . . 0.0 111.217 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.85 -39.69 3.24 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.94 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.3 t -155.76 162.67 40.47 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.533 0.206 . . . . 0.0 110.946 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -94.43 128.22 40.84 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.088 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.84 109.6 20.93 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.97 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.7 mt -128.79 128.64 67.84 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.925 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.99 131.3 48.49 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.741 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 2.3 mt -100.56 133.05 45.58 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.039 -179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -156.57 135.71 12.01 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.06 101.46 1.14 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.88 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -155.74 65.63 0.6 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.649 -179.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -163.78 81.69 0.44 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.997 0.427 . . . . 0.0 111.076 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.75 -41.93 3.02 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.174 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -147.09 178.5 8.32 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.106 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.23 161.98 13.58 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.751 0.31 . . . . 0.0 111.275 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -77.71 162.93 26.61 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.282 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -98.75 175.81 5.84 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.36 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.435 ' O ' ' HB2' ' A' ' 90' ' ' HIS . 22.2 m-70 -96.46 172.56 7.86 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.195 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.435 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 2.4 m-70 69.41 103.47 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.284 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -67.67 173.42 4.27 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.024 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.98 33.81 9.45 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.736 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.087 -0.959 . . . . 0.0 111.262 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 . . . . . 0 C--O 1.233 0.217 0 CA-C-O 121.051 0.453 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.0 t -82.07 134.81 26.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.799 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.2 ttm105 -97.97 113.01 24.73 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.531 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.534 HG23 ' HB2' ' A' ' 75' ' ' LEU . 4.0 mp -114.61 134.09 58.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.185 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -104.33 114.66 29.04 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.878 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.689 ' CD2' HD12 ' A' ' 17' ' ' ILE . 79.4 m-85 -102.52 143.45 32.2 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.153 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.422 ' HG3' ' HG3' ' A' ' 14' ' ' ARG . 36.7 tt0 -133.01 129.51 38.25 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.344 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -139.24 115.1 10.12 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.518 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.02 34.28 23.44 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.234 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.44 -14.24 61.71 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 120.995 -0.622 . . . . 0.0 113.253 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -85.06 119.43 25.44 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.996 0.398 . . . . 0.0 110.641 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.422 ' HG3' ' HG3' ' A' ' 9' ' ' GLU . 2.7 mpt_? -100.05 149.01 23.92 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.195 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.4 mtp-105 -144.41 143.73 31.06 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.32 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mt -103.01 118.85 50.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.842 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.689 HD12 ' CD2' ' A' ' 8' ' ' PHE . 34.1 mt -128.97 135.92 60.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-O 120.77 0.319 . . . . 0.0 111.24 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.15 140.92 37.59 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.337 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.552 ' CE2' HG13 ' A' ' 28' ' ' VAL . 8.5 m-85 -128.3 119.77 25.75 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.026 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.2 t -73.61 125.77 28.78 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.017 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -63.15 148.21 93.31 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.237 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.19 134.01 33.4 Favored 'Cis proline' 0 C--N 1.35 0.612 0 C-N-CA 123.33 -1.529 . . . . 0.0 112.61 0.076 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 23' ' ' VAL . 11.6 p -79.58 114.28 20.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 121.014 0.435 . . . . 0.0 110.948 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.477 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.6 OUTLIER -102.53 140.64 36.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.197 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -59.15 -38.47 79.76 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.929 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.44 -45.06 95.03 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.637 0.256 . . . . 0.0 111.099 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.29 -42.33 88.53 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.179 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.587 ' O ' HG23 ' A' ' 32' ' ' VAL . 40.8 t -70.33 -48.99 57.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.07 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.75 -44.53 96.72 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.444 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -58.52 -39.0 78.92 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.559 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.744 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -67.05 -47.61 70.81 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.761 179.537 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 28' ' ' VAL . 26.3 t -62.51 -44.34 99.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.149 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.8 m -62.43 -39.1 92.22 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.23 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.0 m -71.68 -45.08 63.02 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 121.253 -0.179 . . . . 0.0 111.467 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.744 HG23 ' O ' ' A' ' 31' ' ' LYS . 50.8 t -60.14 -50.19 81.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.492 0.187 . . . . 0.0 111.373 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.461 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 25.0 m-85 -82.33 -25.24 34.07 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.05 22.05 69.44 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.996 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -152.63 152.0 27.92 Favored Pre-proline 0 N--CA 1.463 0.217 0 CA-C-N 116.949 0.374 . . . . 0.0 110.997 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.64 85.0 1.16 Allowed 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.599 2.2 . . . . 0.0 112.131 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.7 mp -85.83 145.09 27.36 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.225 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -97.78 139.73 33.22 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.952 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.8 mt -98.54 127.83 44.63 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.981 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -115.31 116.29 28.05 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.082 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -91.87 108.15 19.72 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.894 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -104.99 117.5 34.16 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.476 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -76.32 -59.97 2.54 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.785 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -178.38 -51.04 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.265 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -103.58 -31.98 9.66 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.522 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.5 tp -119.8 156.4 30.7 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.805 0.336 . . . . 0.0 111.637 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.9 t -116.74 131.28 56.99 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.136 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.9 mm -114.29 133.84 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.977 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.517 HD22 ' HG2' ' A' ' 54' ' ' LYS . 5.7 tt -96.55 135.19 38.79 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.768 0.318 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.459 HD23 ' HB2' ' A' ' 58' ' ' ASP . 3.0 mt -87.83 102.1 14.36 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.176 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.517 ' HG2' HD22 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -106.35 -35.17 7.22 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.349 179.74 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 22.9 p30 -142.8 -179.94 6.63 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.314 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -61.2 -33.62 73.76 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.814 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -53.06 -42.82 66.17 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.951 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.459 ' HB2' HD23 ' A' ' 53' ' ' LEU . 61.7 m-20 -65.28 -44.59 87.54 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.903 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.508 ' HG ' HD11 ' A' ' 63' ' ' ILE . 12.7 tp -67.81 -40.15 83.87 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.09 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.21 -43.25 99.18 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.781 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -64.48 -44.0 92.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.416 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.23 -45.67 92.31 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.864 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.508 HD11 ' HG ' ' A' ' 59' ' ' LEU . 15.0 mt -66.47 -42.16 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 120.556 0.217 . . . . 0.0 110.925 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -56.76 -45.63 81.95 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.244 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 15.9 mt -70.28 -41.24 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.235 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.25 -46.85 88.67 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.952 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.3 -38.43 89.35 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.733 0.302 . . . . 0.0 110.83 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 mmm180 -62.43 -33.75 75.42 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.281 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.9 t -87.69 103.12 15.3 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.978 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 85.5 p -61.78 -31.95 72.19 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.288 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.7 m -60.32 -42.74 96.24 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.924 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mtt -68.61 151.41 46.77 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.119 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -135.83 -64.74 0.61 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.212 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.36 173.0 8.99 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.023 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.534 ' HB2' HG23 ' A' ' 6' ' ' ILE . 6.9 mp -112.97 125.82 54.81 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.103 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 mtt-85 -92.57 107.49 19.25 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.711 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.4 mt -129.59 132.25 66.37 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.868 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.3 tp -102.08 127.38 49.0 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.71 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 8' ' ' PHE . 1.6 mt -93.67 127.71 39.5 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.099 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mp -132.5 142.97 49.44 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.867 0.365 . . . . 0.0 111.375 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.463 0.21 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.968 179.879 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.766 0.317 . . . . 0.0 110.818 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.513 HG23 ' HG3' ' A' ' 21' ' ' ARG . 39.5 t -71.82 131.05 35.11 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.107 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.451 ' NE ' HG21 ' A' ' 16' ' ' ILE . 5.7 ttt180 -86.65 110.45 19.86 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.96 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 21.7 mt -113.56 129.46 69.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.95 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -100.85 123.26 44.78 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.812 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.602 ' CD2' HD12 ' A' ' 17' ' ' ILE . 99.1 m-85 -115.54 133.46 56.02 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.009 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -134.1 127.63 32.52 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.909 0.385 . . . . 0.0 111.326 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -148.43 131.19 16.02 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.59 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 60.51 29.54 19.09 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.266 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.29 -13.86 59.0 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.857 -0.687 . . . . 0.0 113.288 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -83.22 107.74 15.97 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 117.056 0.428 . . . . 0.0 110.942 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.0 ptt180 -97.27 135.99 38.4 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.108 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 -149.75 155.47 40.2 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.3 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.451 HG21 ' NE ' ' A' ' 5' ' ' ARG . 4.3 mt -117.83 120.09 63.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.848 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.602 HD12 ' CD2' ' A' ' 8' ' ' PHE . 22.9 mt -117.39 132.14 68.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.252 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.67 137.07 38.65 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.092 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -128.85 125.88 38.62 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.044 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.3 p -67.75 139.37 56.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.177 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.513 ' HG3' HG23 ' A' ' 4' ' ' VAL . 11.4 mtm180 -88.9 149.67 43.99 Favored Pre-proline 0 C--O 1.234 0.241 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.144 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -74.63 122.34 8.0 Favored 'Cis proline' 0 C--N 1.351 0.669 0 C-N-CA 123.64 -1.4 . . . . 0.0 112.498 0.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.41 ' N ' ' HA ' ' A' ' 21' ' ' ARG . 12.3 p -70.59 125.36 28.72 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.755 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 28' ' ' VAL . 3.9 mttp -95.88 130.37 42.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -56.17 -38.41 70.88 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.741 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.86 -44.36 94.18 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.826 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.46 -41.62 88.77 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.252 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 24' ' ' LYS . 39.3 t -68.03 -48.99 72.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.971 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.26 -43.08 92.47 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.848 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 -42.18 80.73 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.911 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.74 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -63.43 -48.1 79.19 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.222 179.601 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.0 t -62.6 -42.47 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.287 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.5 m -63.93 -39.06 93.3 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.044 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 35.0 m -71.51 -47.15 57.15 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.74 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.3 t -58.54 -49.46 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 120.52 0.2 . . . . 0.0 111.506 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.476 ' CE2' HD13 ' A' ' 79' ' ' LEU . 25.4 m-85 -83.6 -24.66 31.38 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.85 26.29 67.35 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.98 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -157.78 155.94 27.62 Favored Pre-proline 0 C--O 1.233 0.189 0 CA-C-N 116.864 0.332 . . . . 0.0 111.173 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.94 95.65 0.91 Allowed 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.657 2.238 . . . . 0.0 112.165 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mp -100.32 148.6 24.5 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.068 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -100.47 139.78 35.66 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.996 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.452 HD22 HG21 ' A' ' 77' ' ' ILE . 35.6 mt -87.68 106.3 17.95 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.662 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -100.53 114.93 28.96 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.017 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.471 ' CZ ' ' HB1' ' A' ' 62' ' ' ALA . 1.1 t80 -93.46 126.9 38.85 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.168 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -128.26 116.83 20.46 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.812 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -77.5 -49.18 15.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.436 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -172.83 -62.93 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.476 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.65 -23.64 11.35 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.771 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.35 141.07 36.57 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.839 0.352 . . . . 0.0 111.581 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.59 128.16 55.54 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.964 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.2 mt -122.16 133.08 69.57 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.758 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.5 tt -95.07 135.32 36.75 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 mt -97.15 108.79 21.59 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.94 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -107.84 -40.94 5.12 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.221 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.1 p-10 -129.93 179.65 5.74 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.474 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -61.63 -30.92 71.02 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.185 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.25 -46.72 72.66 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.057 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -68.61 -37.52 79.83 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.847 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 tp -66.9 -43.7 82.72 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.805 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -66.53 -37.42 84.98 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.154 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -37.01 84.39 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.762 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.471 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -65.37 -43.64 90.15 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.081 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.635 HD13 HD21 ' A' ' 75' ' ' LEU . 39.4 mm -64.12 -43.25 97.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.143 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -53.82 -46.02 71.0 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.859 0.361 . . . . 0.0 110.848 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.6 mt -64.53 -39.43 85.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.966 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tp -65.23 -46.73 79.43 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.188 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.42 ' OD2' HG22 ' A' ' 63' ' ' ILE . 10.9 m-20 -61.27 -36.61 80.49 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.686 0.279 . . . . 0.0 111.061 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.9 mtt-85 -60.39 -33.53 72.61 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.421 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.6 p -80.32 132.97 35.89 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.728 0.299 . . . . 0.0 111.168 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.2 p -76.21 -33.87 59.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.681 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.2 p -97.31 38.13 1.28 Allowed 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.82 142.78 44.6 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.808 0.337 . . . . 0.0 111.508 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.96 73.37 1.48 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.848 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.7 t 60.64 -169.05 0.16 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.488 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.635 HD21 HD13 ' A' ' 63' ' ' ILE . 2.2 mp -111.01 133.4 53.43 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.024 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.4 mtt85 -101.61 107.49 18.76 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.835 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.452 HG21 HD22 ' A' ' 42' ' ' LEU . 29.9 mt -129.47 132.13 66.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.499 HD23 HD11 ' A' ' 80' ' ' LEU . 0.9 OUTLIER -101.98 120.58 40.64 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.668 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 8' ' ' PHE . 1.8 mt -95.76 124.85 39.97 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.95 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.499 HD11 HD23 ' A' ' 78' ' ' LEU . 11.3 mt -137.41 147.71 45.63 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.006 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.463 0.176 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.074 -179.969 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.517 0.199 . . . . 0.0 110.466 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 24.2 t -70.23 126.55 30.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.608 0.242 . . . . 0.0 110.604 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -86.89 112.75 22.07 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.047 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.435 HD12 ' HD2' ' A' ' 19' ' ' PHE . 4.9 mt -113.23 136.02 50.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.901 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -97.63 127.79 43.85 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.829 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -108.89 134.74 51.16 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.997 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.24 125.87 50.16 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.263 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -149.2 123.4 9.53 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.556 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 57.99 35.52 25.33 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 120.93 0.395 . . . . 0.0 110.878 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.19 12.76 76.29 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.126 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -100.98 145.77 28.26 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.934 0.367 . . . . 0.0 110.96 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -97.79 142.74 29.18 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.217 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.403 ' NH2' HG11 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -144.29 136.91 26.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.188 179.858 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.4 mm -115.16 112.38 39.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.865 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 24.3 mm -129.56 125.98 62.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.928 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.74 146.47 26.5 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.307 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.435 ' HD2' HD12 ' A' ' 6' ' ' ILE . 46.5 m-85 -131.26 120.95 23.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.836 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.4 p -68.08 145.41 54.45 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.968 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 mtt85 -87.55 143.17 33.59 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.086 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -77.52 144.32 76.89 Favored 'Cis proline' 0 C--N 1.349 0.602 0 C-N-CA 123.337 -1.526 . . . . 0.0 112.81 0.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.1 p -99.24 130.44 48.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.989 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.461 ' O ' HG23 ' A' ' 28' ' ' VAL . 7.4 mmtt -102.27 133.19 47.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.805 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.43 ' HE1' HD12 ' A' ' 42' ' ' LEU . 75.8 t80 -57.88 -38.51 75.89 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.927 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.81 -44.11 97.29 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.994 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.94 -44.29 96.48 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.125 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.773 ' O ' HG23 ' A' ' 32' ' ' VAL . 23.9 t -61.29 -48.14 90.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.788 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.19 -43.97 89.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.229 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -57.73 -47.05 83.54 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.988 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.637 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -61.05 -44.7 96.99 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.861 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 28' ' ' VAL . 38.5 t -61.24 -42.7 94.48 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.914 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.4 m -61.66 -39.5 91.61 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.969 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.6 m -71.58 -47.96 51.4 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.755 -0.202 . . . . 0.0 111.373 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 31' ' ' LYS . 42.7 t -61.84 -50.16 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-O 120.62 0.248 . . . . 0.0 111.245 -179.653 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -78.25 -24.13 47.02 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.649 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.61 19.17 74.13 Favored Glycine 0 CA--C 1.525 0.662 0 C-N-CA 121.07 -0.585 . . . . 0.0 113.166 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -168.4 154.31 6.76 Favored Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 116.867 0.334 . . . . 0.0 110.74 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.78 143.62 46.43 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.584 2.189 . . . . 0.0 112.387 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.658 HD13 HG12 ' A' ' 32' ' ' VAL . 1.1 mp -138.07 163.34 31.85 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.072 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.6 125.88 51.16 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.446 HD23 ' HB3' ' A' ' 79' ' ' LEU . 75.2 mt -84.29 113.33 21.05 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.035 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 121.65 44.62 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.193 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.476 ' CE2' ' HB1' ' A' ' 62' ' ' ALA . 21.0 t80 -108.31 116.67 32.39 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.365 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.3 mtt -104.3 133.67 48.81 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.984 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -90.8 -51.13 5.52 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.742 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -171.41 -62.47 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.531 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -107.98 -29.15 9.17 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.43 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.21 160.22 16.0 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.914 0.388 . . . . 0.0 111.32 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.44 132.38 56.24 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.901 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.8 mt -113.65 134.38 56.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.83 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.08 126.73 35.26 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.182 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 44' ' ' TYR . 5.7 mt -88.16 86.48 7.1 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.648 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -106.0 -33.0 8.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.292 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -117.11 158.61 23.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.726 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -59.9 -35.01 73.95 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.711 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.14 -39.96 70.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.117 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -60.75 -45.51 94.03 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.91 0.386 . . . . 0.0 110.793 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 tp -71.04 -38.31 72.54 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.001 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.61 -43.15 90.5 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.108 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -34.37 77.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.954 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.476 ' HB1' ' CE2' ' A' ' 44' ' ' TYR . . . -62.36 -39.77 94.23 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.299 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.4 mm -66.48 -42.88 90.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.595 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -59.03 -45.36 90.93 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.984 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.5 mt -65.75 -44.44 93.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.026 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.5 tp -63.67 -37.96 89.3 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.173 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -57.47 -38.15 74.05 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.995 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.98 -31.56 69.33 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.036 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.9 t -66.69 138.24 57.27 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.802 0.334 . . . . 0.0 111.355 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.9 m -75.55 -35.15 60.73 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.43 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 53.2 p -96.39 37.41 1.26 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.45 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.94 105.45 0.57 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.776 0.322 . . . . 0.0 110.775 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.46 86.9 2.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.588 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 p 55.33 -173.8 0.05 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.416 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 75' ' ' LEU . 3.7 mm? -112.75 130.22 56.14 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -92.99 107.76 19.47 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.916 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.5 mt -129.54 131.18 67.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.763 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.76 118.8 37.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.42 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.446 ' HB3' HD23 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -119.95 129.58 54.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.006 -179.723 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.72 147.39 32.93 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.644 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.464 0.234 0 CA-C-O 121.05 0.452 . . . . 0.0 110.808 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 . . . . . 0 N--CA 1.465 0.312 0 CA-C-O 120.88 0.371 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.6 t -107.37 117.74 53.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.996 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.23 105.15 17.02 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.501 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.5 mt -100.5 116.89 44.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.245 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -109.03 113.73 26.85 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.643 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.63 ' HB2' HD11 ' A' ' 79' ' ' LEU . 24.3 p90 -117.34 146.13 43.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.244 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -128.34 144.46 51.13 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.354 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -143.37 113.05 6.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.491 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 m120 57.6 39.28 27.73 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.233 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.56 -14.09 60.68 Favored Glycine 0 CA--C 1.524 0.616 0 C-N-CA 120.997 -0.62 . . . . 0.0 113.346 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -86.33 103.69 15.15 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 117.066 0.433 . . . . 0.0 110.636 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.98 140.44 29.65 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.273 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.5 mtt85 -134.72 138.59 44.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.99 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mt -117.48 123.38 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.134 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.7 mt -136.18 132.82 49.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.199 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.74 136.25 42.91 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.036 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.479 ' CE2' HG13 ' A' ' 28' ' ' VAL . 83.8 m-85 -124.84 125.56 44.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.792 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -71.5 124.93 25.75 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -73.0 146.39 87.4 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.056 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -74.79 129.19 17.89 Favored 'Cis proline' 0 C--N 1.349 0.568 0 C-N-CA 123.697 -1.376 . . . . 0.0 112.543 -0.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.2 p -96.55 130.58 44.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.249 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.428 ' O ' HG23 ' A' ' 28' ' ' VAL . 9.8 mmtm -89.56 139.84 30.14 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.029 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -59.22 -44.91 92.28 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.04 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.35 -38.86 78.06 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.954 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -65.23 -44.45 88.22 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.033 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.479 HG13 ' CE2' ' A' ' 19' ' ' PHE . 23.2 t -68.19 -49.26 68.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.871 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -59.28 -41.67 89.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.176 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -57.73 -41.68 82.32 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.983 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.754 ' O ' HG23 ' A' ' 35' ' ' VAL . 6.6 tttt -63.29 -48.07 79.65 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.42 -42.14 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.135 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.4 m -65.44 -39.05 91.61 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.228 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.6 m -71.35 -44.71 64.52 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.895 -0.139 . . . . 0.0 111.337 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.754 HG23 ' O ' ' A' ' 31' ' ' LYS . 54.3 t -60.33 -50.02 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.509 0.195 . . . . 0.0 111.214 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.62 ' CE2' HD13 ' A' ' 79' ' ' LEU . 25.7 m-85 -80.17 -26.37 39.33 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.742 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.88 26.75 55.32 Favored Glycine 0 CA--C 1.522 0.475 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.823 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.541 ' O ' HD12 ' A' ' 40' ' ' LEU . 2.5 pt20 -167.21 156.21 9.3 Favored Pre-proline 0 N--CA 1.462 0.169 0 CA-C-N 116.764 0.282 . . . . 0.0 111.0 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.38 109.39 2.83 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.575 2.183 . . . . 0.0 112.279 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.551 HD23 ' HB3' ' A' ' 79' ' ' LEU . 5.6 mp -107.84 134.84 50.2 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.926 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -84.91 133.07 34.3 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.736 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.43 ' HB3' HG21 ' A' ' 77' ' ' ILE . 2.4 mp -92.31 108.81 20.23 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.873 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -104.9 118.93 37.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.22 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.426 ' OH ' HD12 ' A' ' 75' ' ' LEU . 1.1 t80 -91.04 128.89 37.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.81 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.8 ptm -128.42 114.5 16.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.801 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -85.36 -54.15 4.77 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.546 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -167.12 -64.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.401 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -109.5 -23.71 11.36 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.748 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 tt -111.91 146.92 36.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 120.86 0.362 . . . . 0.0 111.305 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 m -120.52 132.78 55.35 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.896 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mp -116.19 133.8 61.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.658 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 tt -98.12 126.56 43.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.831 0.348 . . . . 0.0 110.86 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.8 mt -70.89 97.89 1.49 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.109 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.29 -38.13 11.67 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.182 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -152.61 -173.69 4.65 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.32 -30.79 69.74 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.267 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -53.21 -50.39 64.79 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.081 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.36 -43.5 98.68 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.986 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.51 -38.05 89.65 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.845 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.866 ' HA ' HD12 ' A' ' 63' ' ' ILE . 1.1 t0 -61.39 -43.48 98.79 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.731 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -35.53 81.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.908 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.579 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.58 -35.32 80.12 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.249 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.866 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -64.67 -42.76 95.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.748 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.16 -39.56 63.68 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.031 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.579 HD12 ' HA ' ' A' ' 62' ' ' ALA . 13.8 mt -66.32 -39.46 84.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.847 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.809 HD13 HD13 ' A' ' 75' ' ' LEU . 9.3 tp -62.71 -42.85 99.86 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.986 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -64.02 -34.4 77.91 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.336 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 50.8 ttt85 -75.43 -34.05 60.97 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.098 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.6 t -85.74 129.41 34.84 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.344 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.46 -40.49 29.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.015 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -75.36 -41.78 55.7 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.34 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.49 101.3 0.17 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.799 0.333 . . . . 0.0 111.062 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.13 -37.48 11.57 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.933 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -121.55 175.24 6.31 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.723 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.809 HD13 HD13 ' A' ' 66' ' ' LEU . 1.4 mm? -101.99 129.78 48.36 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.694 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -86.75 108.79 18.85 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.007 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.43 HG21 ' HB3' ' A' ' 42' ' ' LEU . 2.9 mt -124.81 132.08 71.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.095 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 tp -102.17 122.67 44.62 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.483 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.63 HD11 ' HB2' ' A' ' 8' ' ' PHE . 4.6 mt -96.18 135.98 37.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.085 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.04 135.89 14.54 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.984 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.3 p . . . . . 0 C--O 1.233 0.232 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.98 179.968 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 . . . . . 0 N--CA 1.464 0.267 0 CA-C-O 120.847 0.356 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -144.81 132.7 16.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.036 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.81 111.28 20.6 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.512 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.484 HD12 ' CD1' ' A' ' 19' ' ' PHE . 27.7 mt -107.56 118.4 55.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.934 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -96.59 123.01 40.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.933 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.588 ' HB3' HD11 ' A' ' 79' ' ' LEU . 29.4 m-85 -115.73 127.15 54.91 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -122.13 132.62 54.56 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.829 0.347 . . . . 0.0 111.043 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.411 ' HB2' HD12 ' A' ' 79' ' ' LEU . 11.1 t-160 -146.04 117.2 7.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.652 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.52 33.22 22.09 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.21 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.71 -14.0 62.72 Favored Glycine 0 CA--C 1.525 0.658 0 C-N-CA 120.937 -0.649 . . . . 0.0 113.077 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -88.04 110.72 20.84 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.941 0.37 . . . . 0.0 110.887 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.66 144.3 28.9 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.201 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.1 mtt85 -133.49 149.81 51.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.993 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.523 ' N ' HD12 ' A' ' 16' ' ' ILE . 3.7 mp -115.82 112.76 41.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.803 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.527 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.5 mp -123.53 136.91 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 120.861 0.362 . . . . 0.0 111.319 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.13 129.5 42.21 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.027 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.484 ' CD1' HD12 ' A' ' 6' ' ' ILE . 21.4 m-85 -124.76 126.39 45.58 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.967 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 p -66.48 135.74 54.68 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.161 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -100.54 146.31 31.81 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.042 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.21 123.49 9.42 Favored 'Cis proline' 0 C--N 1.35 0.655 0 C-N-CA 123.335 -1.527 . . . . 0.0 112.499 -0.129 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.54 130.03 36.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.975 0.417 . . . . 0.0 111.254 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.562 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -89.54 146.39 24.62 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.044 -179.859 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -56.98 -37.27 71.38 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.083 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -61.32 -43.72 98.4 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.919 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.76 -39.18 87.77 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.142 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 24' ' ' LYS . 18.7 t -67.96 -48.85 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.872 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.46 ' O ' HG22 ' A' ' 33' ' ' THR . 0.2 OUTLIER -58.7 -44.68 90.38 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.926 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.433 ' HA ' HG22 ' A' ' 33' ' ' THR . 2.0 m80 -59.99 -37.03 78.48 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.126 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.692 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -70.94 -48.06 55.59 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.857 179.642 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 28' ' ' VAL . 31.2 t -65.5 -45.75 91.81 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.431 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.46 HG22 ' O ' ' A' ' 29' ' ' GLU . 14.7 t -61.0 -38.93 87.78 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.708 -179.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.6 m -71.24 -43.78 66.62 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.2 t -64.89 -50.53 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 120.576 0.227 . . . . 0.0 111.419 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.565 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 92.1 m-85 -83.72 -13.34 54.23 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.26 24.03 71.86 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.88 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -153.15 147.31 18.75 Favored Pre-proline 0 CA--C 1.529 0.172 0 CA-C-N 116.752 0.276 . . . . 0.0 110.961 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.24 71.73 5.05 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.559 2.173 . . . . 0.0 112.124 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.4 mp -76.92 131.55 38.61 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.847 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -76.98 140.09 40.3 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.991 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.54 HD22 HG21 ' A' ' 77' ' ' ILE . 33.5 mt -82.18 118.58 23.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.897 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -116.94 119.6 35.83 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.995 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.554 ' HB2' HD11 ' A' ' 53' ' ' LEU . 0.8 OUTLIER -90.63 117.27 29.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.82 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.7 115.65 22.44 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.827 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -86.53 -72.21 0.51 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.053 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -134.9 -67.43 0.56 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.608 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -122.78 18.56 10.26 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.207 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.0 tp -131.68 138.22 48.62 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.604 0.24 . . . . 0.0 110.979 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.97 122.52 39.54 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.765 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.8 mp -114.44 131.14 67.36 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.684 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.2 tt -92.13 127.88 37.77 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.874 0.369 . . . . 0.0 111.116 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.782 ' CD2' HD12 ' A' ' 59' ' ' LEU . 5.8 mp -92.95 90.06 6.8 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.789 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.88 -31.82 15.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.145 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -132.08 174.49 10.14 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.989 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.59 -32.05 72.98 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.294 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -54.28 -42.2 69.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.71 0.29 . . . . 0.0 110.94 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.64 -46.19 83.59 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.162 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.782 HD12 ' CD2' ' A' ' 53' ' ' LEU . 2.3 tp -61.77 -41.92 98.32 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.599 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.841 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.5 t0 -61.52 -41.77 97.81 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.734 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.87 -39.49 94.33 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.835 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.435 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -62.81 -38.42 90.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.333 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.841 HD12 ' HA ' ' A' ' 60' ' ' ASP . 7.5 mt -64.37 -44.04 97.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.599 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -56.0 -42.4 76.35 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.052 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.435 HD12 ' HA ' ' A' ' 62' ' ' ALA . 17.1 mt -66.12 -45.57 90.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.112 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.454 ' CD2' HD11 ' A' ' 75' ' ' LEU . 8.4 tp -58.9 -43.47 91.04 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.803 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -69.29 -36.77 77.38 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.036 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -26.64 68.8 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.27 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.2 t -62.36 164.72 6.83 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.912 0.386 . . . . 0.0 111.382 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 p -64.06 -40.72 96.89 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.185 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.5 p -163.93 -63.92 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.232 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 63.16 -177.58 0.15 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.135 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -152.61 115.41 4.57 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.789 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.513 ' C ' HD12 ' A' ' 75' ' ' LEU . 0.4 OUTLIER 64.06 -172.2 0.17 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.954 -179.872 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.513 HD12 ' C ' ' A' ' 74' ' ' SER . 8.2 mp -125.39 125.85 44.06 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.721 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -86.2 107.07 17.73 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.914 0.387 . . . . 0.0 110.606 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.54 HG21 HD22 ' A' ' 42' ' ' LEU . 8.2 mt -127.85 131.53 69.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.723 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.47 HD13 ' HA ' ' A' ' 78' ' ' LEU . 3.6 mm? -101.93 128.95 48.11 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.538 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.588 HD11 ' HB3' ' A' ' 8' ' ' PHE . 1.4 mt -94.15 133.65 37.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.023 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.7 mt -135.37 143.78 46.25 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.146 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t . . . . . 0 C--O 1.233 0.213 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.899 179.87 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 . . . . . 0 N--CA 1.465 0.298 0 CA-C-O 120.653 0.263 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -138.75 141.43 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.245 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -95.01 105.5 17.42 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.916 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.455 HG23 HD12 ' A' ' 75' ' ' LEU . 2.7 mt -111.72 116.96 53.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.882 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -96.1 118.31 32.43 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.75 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.669 ' HB3' HD11 ' A' ' 79' ' ' LEU . 36.4 m-85 -96.83 129.17 44.3 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.019 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.405 ' O ' HD12 ' A' ' 79' ' ' LEU . 5.4 tt0 -119.09 128.68 54.55 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.875 0.369 . . . . 0.0 111.691 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -142.2 120.1 11.99 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.525 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 44.1 t30 54.96 38.28 30.21 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.793 0.33 . . . . 0.0 111.072 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 84.52 -14.51 46.09 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 121.168 -0.539 . . . . 0.0 113.588 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -87.32 121.02 29.22 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 117.22 0.51 . . . . 0.0 110.855 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -100.33 154.45 18.48 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.369 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.9 mtt-85 -140.04 139.97 36.07 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.913 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.9 mt -108.75 114.79 47.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.225 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.8 mt -139.88 136.06 38.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.235 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.69 133.57 41.06 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.303 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.412 ' HB2' ' CD1' ' A' ' 6' ' ' ILE . 21.5 m-85 -121.86 129.36 52.53 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.89 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.24 157.87 25.03 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.869 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.421 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 2.0 mtm105 -109.51 153.98 42.56 Favored Pre-proline 0 C--O 1.234 0.253 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.113 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.421 ' HA ' ' HB3' ' A' ' 21' ' ' ARG . 72.9 Cg_endo -75.74 131.79 25.4 Favored 'Cis proline' 0 C--N 1.349 0.593 0 C-N-CA 123.189 -1.588 . . . . 0.0 112.756 0.048 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.9 p -105.6 125.73 60.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.871 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -87.04 137.46 32.33 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.727 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.484 ' CE1' HD12 ' A' ' 42' ' ' LEU . 65.5 t80 -55.68 -38.72 70.01 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.754 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.06 -43.49 95.39 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.165 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -62.63 -43.8 97.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.166 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.498 ' O ' HG23 ' A' ' 32' ' ' VAL . 39.8 t -69.09 -45.15 80.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.457 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -61.81 -38.4 87.96 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.358 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.87 -47.46 82.65 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.807 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.675 ' O ' HG23 ' A' ' 35' ' ' VAL . 11.2 mtpp -61.4 -46.59 89.52 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.894 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 28' ' ' VAL . 48.2 t -57.47 -48.17 83.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.919 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.7 m -62.33 -39.37 92.87 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.37 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.1 m -71.71 -46.26 59.23 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 31' ' ' LYS . 61.7 t -61.44 -50.16 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.514 0.197 . . . . 0.0 111.488 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -83.4 -21.46 33.01 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.41 30.35 64.75 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.812 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.569 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -168.2 151.87 5.78 Favored Pre-proline 0 N--CA 1.463 0.2 0 CA-C-N 116.59 0.195 . . . . 0.0 111.081 -179.968 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -75.17 107.38 2.47 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.573 2.182 . . . . 0.0 112.236 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.569 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.4 mp -105.44 143.16 33.99 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.298 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -88.62 129.46 35.5 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.781 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.742 HD23 HD23 ' A' ' 79' ' ' LEU . 50.7 mt -86.12 103.01 14.37 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.904 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -93.08 120.92 33.89 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.101 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.55 ' CE2' ' HB1' ' A' ' 62' ' ' ALA . 0.6 OUTLIER -96.86 125.38 41.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.994 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.2 ptp -126.65 114.23 17.76 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.035 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -86.94 -54.3 4.42 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.801 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -157.13 -65.81 0.1 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.506 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -126.2 13.23 7.74 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.533 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.6 tp -131.62 132.96 44.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.628 0.251 . . . . 0.0 110.961 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 m -110.51 126.07 53.99 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.963 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.0 mt -114.63 134.12 58.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.89 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 tt -92.08 122.3 34.45 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.81 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.427 HD21 ' HA ' ' A' ' 59' ' ' LEU . 3.1 mt -80.39 87.26 5.65 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.058 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.98 -31.75 14.78 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.382 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -142.85 -179.63 6.46 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.891 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -62.68 -31.35 72.23 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.14 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.24 -43.81 67.62 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.1 0.25 . . . . 0.0 111.099 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.25 -40.05 89.94 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.188 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.427 ' HA ' HD21 ' A' ' 53' ' ' LEU . 6.5 tp -69.3 -41.38 76.84 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.763 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -65.89 -40.21 91.34 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.341 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.8 tptt -62.67 -36.94 84.5 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.396 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.55 ' HB1' ' CE2' ' A' ' 44' ' ' TYR . . . -63.06 -38.31 90.69 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.343 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 54.0 mt -62.75 -42.52 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.005 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.25 -45.54 72.39 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.119 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 4.9 mt -69.37 -41.92 81.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.906 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.476 HD22 HD22 ' A' ' 75' ' ' LEU . 13.7 tp -61.39 -44.52 97.01 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.029 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -61.47 -39.26 90.24 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.045 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 7.8 mtm-85 -62.65 -34.3 76.79 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.243 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.0 t -87.01 119.98 27.78 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.806 0.336 . . . . 0.0 111.212 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 71.9 m -78.19 -32.47 50.08 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.253 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.6 p -93.47 35.7 1.1 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.699 0.285 . . . . 0.0 111.612 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.42 ' HE2' HD12 ' A' ' 66' ' ' LEU . 3.8 ttp -147.41 80.96 1.52 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.821 0.343 . . . . 0.0 110.816 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -103.18 31.44 4.27 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.335 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.5 m -156.52 142.52 18.03 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.65 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.879 HD12 HD11 ' A' ' 77' ' ' ILE . 0.1 OUTLIER -116.46 131.94 56.81 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 111.189 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -99.72 118.15 35.61 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.048 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.879 HD11 HD12 ' A' ' 75' ' ' LEU . 2.3 mp -125.22 132.39 71.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.759 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 mt -101.94 119.42 38.77 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.679 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.742 HD23 HD23 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -93.39 119.95 33.1 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.998 -179.805 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 pp -130.9 136.54 48.69 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.978 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 54.7 p . . . . . 0 C--N 1.331 -0.211 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.788 179.716 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.728 0.299 . . . . 0.0 110.424 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.522 HG11 HD12 ' A' ' 63' ' ' ILE . 21.2 t -78.21 135.82 25.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.857 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.95 107.25 18.3 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.857 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.567 HD12 ' HD2' ' A' ' 19' ' ' PHE . 27.3 mt -110.01 120.6 61.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.977 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.09 119.2 38.4 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.669 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.905 ' HB3' HD11 ' A' ' 79' ' ' LEU . 49.7 m-85 -100.74 127.2 47.26 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.481 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.409 ' O ' HD12 ' A' ' 79' ' ' LEU . 25.8 tt0 -118.82 131.2 56.08 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.874 0.369 . . . . 0.0 111.37 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -141.74 120.62 12.75 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.513 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 m120 56.13 34.99 24.9 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.511 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.13 -14.19 61.37 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 120.915 -0.659 . . . . 0.0 113.159 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -89.43 116.93 27.98 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 117.055 0.428 . . . . 0.0 110.429 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.14 144.16 39.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.394 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.1 mtt-85 -133.98 139.41 46.06 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.9 mp -102.27 118.59 49.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.235 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -137.04 129.96 44.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.974 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.31 142.87 27.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.118 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.567 ' HD2' HD12 ' A' ' 6' ' ' ILE . 43.1 m-85 -133.84 118.08 17.57 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.941 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.5 t -64.62 130.47 43.75 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.977 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.435 ' HG3' HG23 ' A' ' 4' ' ' VAL . 4.0 mtm180 -74.46 160.02 82.18 Favored Pre-proline 0 CA--C 1.53 0.195 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.346 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.86 130.17 19.9 Favored 'Cis proline' 0 C--N 1.35 0.609 0 C-N-CA 123.219 -1.576 . . . . 0.0 112.558 -0.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -71.61 125.18 29.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.021 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.445 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -102.17 137.94 39.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.928 -179.709 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -55.91 -45.03 78.79 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.735 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -39.69 94.44 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.03 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.12 -44.41 95.71 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.105 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 24' ' ' LYS . 42.6 t -67.97 -48.42 74.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.881 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -39.24 93.48 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.111 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -58.0 -39.4 78.17 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.933 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.732 ' O ' HG23 ' A' ' 35' ' ' VAL . 4.1 tptt -69.23 -47.49 64.59 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.062 179.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.551 HG11 HD22 ' A' ' 79' ' ' LEU . 25.6 t -68.24 -43.6 84.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.477 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.7 m -60.38 -38.66 84.6 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.102 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.4 m -71.49 -43.79 65.91 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 111.464 0.172 . . . . 0.0 111.464 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.732 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.1 t -63.34 -50.86 77.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 120.535 0.207 . . . . 0.0 111.42 -179.479 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -83.48 -18.68 37.7 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.21 21.06 75.55 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 121.067 -0.587 . . . . 0.0 113.052 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.515 ' O ' HD12 ' A' ' 40' ' ' LEU . 34.1 mt-30 -149.71 151.64 33.23 Favored Pre-proline 0 CA--C 1.53 0.178 0 CA-C-N 116.94 0.37 . . . . 0.0 110.933 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -75.32 95.0 0.97 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.634 2.223 . . . . 0.0 112.122 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 38' ' ' GLN . 5.8 mp -93.52 145.32 24.6 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.232 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.452 ' OD2' HD11 ' A' ' 52' ' ' LEU . 4.2 t0 -91.96 130.92 37.61 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.733 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.625 HD23 HG21 ' A' ' 77' ' ' ILE . 4.3 mp -90.2 103.08 15.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.946 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.431 ' NE2' HD12 ' A' ' 52' ' ' LEU . 2.2 m80 -94.71 120.08 34.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.197 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -99.08 120.54 39.64 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.537 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.02 129.67 56.17 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.671 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -90.46 -50.67 5.82 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.735 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -171.99 -63.63 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.454 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -109.19 -26.69 9.97 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.397 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.27 138.99 40.6 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.754 0.312 . . . . 0.0 111.279 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.2 t -110.31 129.64 55.7 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.888 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.7 mt -120.01 134.09 64.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.811 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.452 HD11 ' OD2' ' A' ' 41' ' ' ASP . 3.3 tt -99.32 135.1 41.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.676 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.508 HD21 ' HA ' ' A' ' 59' ' ' LEU . 10.3 mt -73.85 86.48 1.74 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.024 0.44 . . . . 0.0 111.096 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.5 tptp -80.55 -36.63 32.76 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.234 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -152.33 178.54 9.42 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.247 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -58.3 -33.0 68.98 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.09 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.63 -43.47 72.3 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.699 0.285 . . . . 0.0 110.86 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -67.35 -40.44 85.85 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.676 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.508 ' HA ' HD21 ' A' ' 53' ' ' LEU . 9.3 tp -64.49 -44.6 90.45 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.153 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.3 -38.63 91.9 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.139 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.9 mttt -62.99 -41.93 99.7 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.494 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.82 -45.39 92.83 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.183 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.525 HD13 HD11 ' A' ' 75' ' ' LEU . 44.2 mm -65.04 -44.92 95.81 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.134 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.085 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.7 -45.54 85.56 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.379 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.9 mt -70.06 -45.16 77.27 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.969 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.567 HD21 ' O ' ' A' ' 74' ' ' SER . 9.2 tp -63.72 -46.4 85.56 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.375 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.78 -40.78 84.99 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.807 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -68.3 -33.59 74.6 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.101 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.6 t -82.31 113.91 20.43 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.923 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 m -75.25 -29.2 60.14 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.997 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.61 -35.26 65.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.184 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 mmm -108.46 154.85 21.31 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.102 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.6 mmtm -134.77 -52.14 0.8 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.709 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.567 ' O ' HD21 ' A' ' 66' ' ' LEU . 1.9 p -79.0 169.73 17.76 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.034 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.624 HD22 HD11 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -111.58 121.65 45.71 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.044 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.48 108.19 19.5 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.821 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.625 HG21 HD23 ' A' ' 42' ' ' LEU . 27.8 mt -128.94 132.2 67.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.853 HD23 HD11 ' A' ' 80' ' ' LEU . 3.5 tp -102.12 119.48 38.88 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.509 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.905 HD11 ' HB3' ' A' ' 8' ' ' PHE . 2.8 mt -93.54 131.64 38.6 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.955 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.853 HD11 HD23 ' A' ' 78' ' ' LEU . 5.0 mp -142.12 138.45 31.66 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.792 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.463 0.185 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.371 -179.797 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 . . . . . 0 N--CA 1.468 0.455 0 CA-C-O 120.764 0.316 . . . . 0.0 111.508 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.9 t -93.05 130.76 41.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.949 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -87.21 113.94 23.38 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.761 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 mm -106.69 123.98 61.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.21 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.406 ' HD3' HG13 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -108.66 111.8 23.79 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.752 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.655 ' CD2' HD11 ' A' ' 79' ' ' LEU . 11.2 p90 -116.41 149.14 39.91 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.305 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -118.01 139.85 50.6 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.086 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.682 ' HB2' HD12 ' A' ' 79' ' ' LEU . 85.6 t60 -146.03 114.54 6.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.436 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 t30 58.72 35.01 24.17 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.135 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.72 12.47 81.48 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.071 -0.585 . . . . 0.0 113.177 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -111.29 122.07 46.9 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 117.059 0.43 . . . . 0.0 110.736 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -93.32 139.72 30.34 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.147 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.439 ' HB2' ' CE2' ' A' ' 8' ' ' PHE . 16.0 mmt180 -139.04 136.7 35.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.161 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.406 HG13 ' HD3' ' A' ' 7' ' ' LYS . 2.4 mp -117.01 129.63 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.221 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 32.7 mt -140.92 129.62 24.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.131 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.6 134.61 34.27 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.031 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -129.2 121.48 27.76 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.045 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p -66.39 136.49 55.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.898 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -77.41 147.22 75.31 Favored Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.993 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.83 133.84 31.9 Favored 'Cis proline' 0 C--N 1.35 0.633 0 C-N-CA 123.347 -1.522 . . . . 0.0 112.625 0.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.7 p -81.46 123.45 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.091 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -102.66 143.76 31.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.01 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.552 ' HB2' HD13 ' A' ' 59' ' ' LEU . 62.6 t80 -60.27 -42.1 94.71 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.6 179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.418 ' HG2' ' CD2' ' A' ' 30' ' ' HIS . 12.2 tt0 -57.89 -41.6 82.88 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.098 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -62.48 -44.45 96.37 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.087 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.715 ' O ' HG23 ' A' ' 32' ' ' VAL . 37.3 t -70.99 -48.44 55.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.893 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -40.54 85.01 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.392 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' HIS . . . . . 0.418 ' CD2' ' HG2' ' A' ' 26' ' ' GLU . 4.5 m-70 -57.9 -46.67 84.59 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.697 0.284 . . . . 0.0 111.06 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.78 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -71.4 -48.26 50.92 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.094 179.986 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 28' ' ' VAL . 48.4 t -56.99 -46.29 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.374 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 91.4 m -61.2 -38.85 88.06 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.952 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.1 m -71.3 -42.27 68.88 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 111.481 0.178 . . . . 0.0 111.481 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.78 HG23 ' O ' ' A' ' 31' ' ' LYS . 41.5 t -60.2 -49.97 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-O 120.607 0.241 . . . . 0.0 111.068 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.686 ' CE2' HD13 ' A' ' 79' ' ' LEU . 69.7 m-85 -83.61 -25.79 30.55 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.883 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.35 14.0 62.7 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.03 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -154.39 152.16 25.6 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.977 0.389 . . . . 0.0 110.872 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -72.46 79.74 1.78 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.641 2.227 . . . . 0.0 112.29 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.7 mp -75.31 140.03 42.85 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.878 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.0 136.81 32.79 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.02 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.536 HD22 HG21 ' A' ' 77' ' ' ILE . 10.9 mt -86.19 118.69 25.8 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.91 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.1 m170 -109.07 119.58 39.96 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.063 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -120.22 128.35 53.28 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.796 0.331 . . . . 0.0 110.672 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.5 mtm -110.49 118.52 36.47 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.377 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -60.8 -67.5 0.39 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.876 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.88 -59.79 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.37 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.456 ' O ' HD22 ' A' ' 49' ' ' LEU . 7.2 mt-10 -120.96 11.6 11.05 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.604 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.456 HD22 ' O ' ' A' ' 48' ' ' GLU . 1.4 mm? -131.22 159.2 38.47 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.689 0.281 . . . . 0.0 111.019 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.4 p -118.1 118.53 32.14 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.05 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.7 mt -113.67 133.9 58.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.858 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.3 tt -96.44 123.29 40.04 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.945 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.734 HD23 ' HB3' ' A' ' 58' ' ' ASP . 7.3 mt -92.34 81.0 4.93 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.864 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.2 tttp -103.5 -32.82 9.29 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.972 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -107.9 165.57 11.36 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.8 0.333 . . . . 0.0 111.102 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -35.85 80.72 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.952 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.47 -42.65 74.63 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.025 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.734 ' HB3' HD23 ' A' ' 53' ' ' LEU . 54.8 m-20 -60.1 -44.48 94.79 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.661 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.552 HD13 ' HB2' ' A' ' 25' ' ' TYR . 4.9 tt -66.28 -40.69 90.27 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.074 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.11 -41.45 96.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.904 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -66.32 -37.27 84.99 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.061 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.509 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.17 -45.42 91.89 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.348 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 42.3 mm -66.11 -41.04 88.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.775 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -55.33 -41.17 72.1 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.085 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.509 HD12 ' HA ' ' A' ' 62' ' ' ALA . 7.6 mt -66.81 -41.43 87.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.922 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.798 HD22 HD21 ' A' ' 75' ' ' LEU . 38.5 tp -62.76 -41.98 99.47 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.007 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -58.62 -38.01 77.13 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.209 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -31.75 64.99 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.298 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.9 t -98.9 93.09 5.84 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.219 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 89.2 p -67.88 -31.31 71.02 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.388 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.2 p -56.43 -43.67 79.65 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.182 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 6.2 ttp -83.47 157.39 22.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.223 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.4 mttm -143.73 -51.28 0.32 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.93 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.9 m -79.6 149.74 31.26 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.076 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.798 HD21 HD22 ' A' ' 66' ' ' LEU . 3.9 mm? -113.9 126.48 55.22 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.898 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.5 mtt-85 -93.02 109.91 21.37 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.944 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.536 HG21 HD22 ' A' ' 42' ' ' LEU . 38.6 mt -128.93 132.2 67.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.094 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.7 mp -102.21 132.03 48.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.673 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.686 HD13 ' CE2' ' A' ' 36' ' ' PHE . 1.7 mt -94.15 132.34 38.78 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.09 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 89.1 mt -143.63 137.31 28.21 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.905 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 p . . . . . 0 C--O 1.233 0.196 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.131 -179.813 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 . . . . . 0 C--O 1.234 0.25 0 CA-C-O 121.014 0.435 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -85.72 135.88 24.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.173 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -95.84 106.16 18.26 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.888 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.442 HD12 ' CD2' ' A' ' 19' ' ' PHE . 33.3 mt -101.09 126.38 54.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.018 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -98.83 116.37 30.91 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.913 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -93.38 145.63 24.34 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.247 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.32 132.76 50.2 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.348 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -146.14 113.85 6.42 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.626 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 58.3 33.74 23.42 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.12 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.96 -13.64 62.56 Favored Glycine 0 CA--C 1.526 0.719 0 C-N-CA 120.917 -0.659 . . . . 0.0 113.048 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -77.05 152.58 35.03 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 117.007 0.404 . . . . 0.0 110.949 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -115.54 144.7 43.49 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.4 144.85 46.78 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.925 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.4 mt -115.51 120.28 64.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.18 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 31.3 mt -141.62 126.58 17.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.238 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.51 135.24 33.99 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.162 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.442 ' CD2' HD12 ' A' ' 6' ' ' ILE . 37.1 m-85 -127.02 128.37 46.23 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.051 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.9 p -87.1 123.06 31.75 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.669 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -64.91 154.08 86.96 Favored Pre-proline 0 C--O 1.233 0.232 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.264 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.39 127.34 14.79 Favored 'Cis proline' 0 C--N 1.35 0.616 0 C-N-CA 123.343 -1.524 . . . . 0.0 112.733 0.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.9 p -84.26 122.83 38.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.887 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.684 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -98.55 142.69 29.83 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.079 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.746 ' CE1' HD12 ' A' ' 42' ' ' LEU . 70.9 t80 -60.39 -42.41 95.84 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.987 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.416 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 16.2 mt-10 -61.56 -39.41 91.01 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.954 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -68.75 -44.28 74.07 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.015 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 24' ' ' LYS . 29.1 t -62.22 -48.02 90.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.838 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.416 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 10.8 pt-20 -63.78 -34.79 78.68 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.261 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.2 -48.38 80.51 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.047 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -63.48 -40.59 97.5 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.743 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 28' ' ' VAL . 41.8 t -64.97 -44.19 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.314 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 m -65.23 -38.88 91.75 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.965 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 m -71.55 -47.35 55.65 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.46 HG13 ' N ' ' A' ' 36' ' ' PHE . 13.5 p -59.92 -48.8 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.692 ' CE2' HD13 ' A' ' 79' ' ' LEU . 65.6 m-85 -84.01 -18.11 38.22 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.47 28.47 69.53 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.711 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.473 ' O ' HD12 ' A' ' 40' ' ' LEU . 1.2 pt20 -162.49 156.32 17.88 Favored Pre-proline 0 CA--C 1.529 0.158 0 CA-C-N 116.725 0.263 . . . . 0.0 110.922 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.04 107.12 2.29 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.664 2.243 . . . . 0.0 112.526 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.503 HD23 ' HB3' ' A' ' 79' ' ' LEU . 6.1 mp -108.65 126.44 52.98 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.029 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.44 135.4 39.41 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.842 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.746 HD12 ' CE1' ' A' ' 25' ' ' TYR . 73.5 mt -83.18 95.59 8.16 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.932 0.396 . . . . 0.0 110.536 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 -87.56 118.01 26.75 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.188 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.471 ' CD1' HD12 ' A' ' 51' ' ' ILE . 18.9 t80 -107.52 118.63 37.23 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.447 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.4 mmm -117.61 131.65 56.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.06 -48.74 7.83 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.586 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -173.15 -62.66 0.02 OUTLIER 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.482 179.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -111.29 -25.29 9.75 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.81 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.628 HD13 ' N ' ' A' ' 50' ' ' SER . 1.1 tm? -101.38 132.22 47.07 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 111.261 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.628 ' N ' HD13 ' A' ' 49' ' ' LEU . 1.0 OUTLIER -97.81 127.62 43.88 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.988 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.471 HD12 ' CD1' ' A' ' 44' ' ' TYR . 22.0 mt -118.11 131.51 70.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.011 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.4 tt -101.31 121.74 42.44 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.807 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.727 HD12 ' HB3' ' A' ' 42' ' ' LEU . 43.9 mt -79.14 100.64 7.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.65 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.52 -34.99 11.84 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.118 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -141.61 178.52 7.41 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.901 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -32.79 73.65 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.268 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.1 -47.68 71.52 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.648 0.261 . . . . 0.0 111.145 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -65.59 -46.2 80.31 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.0 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.456 HD13 HD13 ' A' ' 53' ' ' LEU . 10.3 tp -62.71 -42.46 99.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.146 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.24 -36.38 81.53 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.066 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.86 -36.48 83.4 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.651 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.549 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -65.22 -36.42 84.1 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.113 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.726 ' CD1' HD21 ' A' ' 75' ' ' LEU . 25.8 mm -64.56 -46.07 93.68 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.903 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.81 -40.25 69.34 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.267 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.549 HD12 ' HA ' ' A' ' 62' ' ' ALA . 11.7 mt -68.35 -45.63 82.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.893 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.3 tp -66.6 -42.62 86.61 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.027 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.85 -42.65 84.9 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.111 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -69.81 -30.4 67.92 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.925 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.5 t -69.2 146.69 52.18 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.817 0.342 . . . . 0.0 111.147 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.4 m -75.84 -20.83 57.82 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.617 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 76.1 p -94.43 38.69 1.09 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.792 0.329 . . . . 0.0 111.426 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.38 120.64 24.09 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.594 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.35 -68.18 0.19 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.963 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.31 173.19 8.54 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.872 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.726 HD21 ' CD1' ' A' ' 63' ' ' ILE . 5.3 mp -109.24 125.76 52.6 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.12 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 26.9 ttt180 -86.7 107.33 18.17 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.708 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.743 HG21 HD22 ' A' ' 42' ' ' LEU . 28.9 mt -129.7 131.89 66.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.963 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.4 mt -102.03 127.64 48.82 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.817 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.692 HD13 ' CE2' ' A' ' 36' ' ' PHE . 40.0 mt -93.74 119.67 33.02 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.101 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mp -144.95 144.89 31.3 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.917 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.234 0.26 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.82 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.467 0.386 0 CA-C-O 120.746 0.308 . . . . 0.0 111.071 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.3 t -108.74 139.82 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.205 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.61 113.31 25.38 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.225 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.649 HD12 ' CD2' ' A' ' 19' ' ' PHE . 24.0 mt -110.14 123.93 66.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.823 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.418 ' HG3' ' HB3' ' A' ' 74' ' ' SER . 9.0 mttm -95.92 119.94 35.32 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.663 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.843 ' HB3' HD11 ' A' ' 79' ' ' LEU . 97.8 m-85 -106.58 141.26 38.16 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.098 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -120.82 125.75 48.35 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.126 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.441 ' HB2' HD12 ' A' ' 79' ' ' LEU . 5.6 t-160 -140.65 116.75 10.53 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.603 179.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 57.65 32.92 22.57 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.142 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.77 -14.25 60.63 Favored Glycine 0 CA--C 1.525 0.711 0 C-N-CA 120.876 -0.678 . . . . 0.0 113.137 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.76 129.02 34.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.963 0.382 . . . . 0.0 110.859 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.61 135.01 45.02 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.949 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -139.51 143.95 37.7 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.423 ' N ' HD12 ' A' ' 16' ' ' ILE . 3.8 mp -116.37 121.25 67.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.94 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.2 mm -123.4 136.35 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.347 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -100.22 134.12 43.62 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.011 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.649 ' CD2' HD12 ' A' ' 6' ' ' ILE . 81.0 m-85 -128.0 125.87 40.25 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.091 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.2 t -85.56 150.97 24.28 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.97 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -86.62 150.78 51.77 Favored Pre-proline 0 CA--C 1.529 0.173 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.428 179.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.09 127.22 14.61 Favored 'Cis proline' 0 C--N 1.349 0.582 0 C-N-CA 123.573 -1.428 . . . . 0.0 112.752 0.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.5 p -93.07 129.88 42.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.057 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.454 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -100.59 143.63 30.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.104 -179.713 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -57.36 -52.58 64.79 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.872 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.03 -35.27 74.73 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.036 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -62.39 -44.77 95.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.719 0.295 . . . . 0.0 110.987 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 24' ' ' LYS . 39.6 t -67.69 -48.43 76.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.52 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -62.75 -36.84 84.36 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.46 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -57.69 -45.03 86.18 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.026 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.671 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.6 OUTLIER -61.13 -46.48 90.41 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.776 179.793 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.653 HG11 HD22 ' A' ' 79' ' ' LEU . 33.8 t -61.65 -47.45 93.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.208 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 m -65.69 -38.74 90.09 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.388 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.0 m -71.5 -48.48 48.7 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 111.55 0.204 . . . . 0.0 111.55 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.671 HG23 ' O ' ' A' ' 31' ' ' LYS . 59.9 t -61.39 -50.06 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.474 0.178 . . . . 0.0 111.36 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.629 ' HE2' HD13 ' A' ' 79' ' ' LEU . 24.4 m-85 -80.74 -20.13 43.43 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.47 34.41 73.85 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.802 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.455 ' OE1' ' HB3' ' A' ' 81' ' ' SER . 1.1 pt20 -167.6 149.65 5.33 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.73 0.265 . . . . 0.0 111.238 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.65 126.84 8.44 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.76 2.307 . . . . 0.0 112.709 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.426 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.4 mp -133.79 144.51 49.07 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.919 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.34 130.17 37.23 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.636 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 53' ' ' LEU . 1.1 mp -81.6 116.74 21.5 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.083 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.412 ' ND1' HD21 ' A' ' 80' ' ' LEU . 3.8 m80 -102.03 121.26 41.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.186 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.554 ' HD2' HD11 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -94.62 128.78 41.5 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.794 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.2 ptt? -131.59 114.56 14.99 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.742 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -90.57 -66.01 0.96 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.718 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -146.04 -70.42 0.26 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.409 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -112.46 -16.0 12.98 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.62 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -110.7 139.78 45.67 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.802 0.334 . . . . 0.0 111.253 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.1 m -120.77 124.68 45.71 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.598 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.9 mt -114.96 134.44 58.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.024 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.432 HD23 ' N ' ' A' ' 53' ' ' LEU . 4.1 tt -92.0 129.37 37.97 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.185 -179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.554 HD11 ' HD2' ' A' ' 44' ' ' TYR . 8.2 mt -82.36 90.44 6.68 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.058 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -106.74 -33.67 7.53 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.158 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.05 167.08 11.47 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.062 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.36 -37.07 85.92 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.061 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -55.47 -37.59 67.97 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.238 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.481 ' HB3' HD23 ' A' ' 53' ' ' LEU . 2.0 t70 -65.52 -41.74 92.78 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.672 0.273 . . . . 0.0 110.819 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.438 HD12 HD22 ' A' ' 53' ' ' LEU . 0.6 OUTLIER -66.79 -42.29 86.21 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.979 179.73 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -68.79 -41.64 78.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.009 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -36.49 81.9 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.818 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.536 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -64.83 -40.43 95.18 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.369 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.0 mt -65.06 -41.44 91.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.035 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -53.41 -44.42 68.73 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.173 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 37.5 mt -68.85 -44.2 81.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.05 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.48 -43.41 97.38 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.925 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -60.51 -40.45 91.46 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.36 -32.84 73.21 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.16 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.3 t -89.33 107.63 19.17 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.291 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 12.9 t -70.64 -29.03 65.28 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.672 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 p -60.71 -61.72 2.38 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.0 ttt -76.32 115.76 16.37 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.767 0.318 . . . . 0.0 111.248 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.8 mttm -93.11 -37.02 12.36 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.426 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.418 ' HB3' ' HG3' ' A' ' 7' ' ' LYS . 1.7 m -110.72 166.17 11.23 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.625 0.25 . . . . 0.0 111.108 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.637 ' CD1' HG23 ' A' ' 6' ' ' ILE . 0.3 OUTLIER -116.86 136.7 52.75 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.107 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.435 ' O ' HD13 ' A' ' 77' ' ' ILE . 3.5 mtp85 -86.32 116.59 24.58 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.158 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.607 HD11 HD12 ' A' ' 75' ' ' LEU . 24.2 mm -126.65 129.84 71.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.227 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.3 mp -102.15 125.67 48.9 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.607 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.843 HD11 ' HB3' ' A' ' 8' ' ' PHE . 2.0 mt -98.08 129.44 44.91 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.089 -179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.412 HD21 ' ND1' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -149.62 135.41 18.65 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.253 179.822 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.455 ' HB3' ' OE1' ' A' ' 38' ' ' GLN . 81.6 p . . . . . 0 C--O 1.234 0.251 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.456 179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 t70 . . . . . 0 C--O 1.232 0.183 0 CA-C-O 120.805 0.336 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -98.93 131.66 45.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.034 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.43 ' HE ' HG21 ' A' ' 16' ' ' ILE . 7.2 ttt180 -90.16 105.56 17.89 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.893 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.629 HG23 ' HB2' ' A' ' 75' ' ' LEU . 1.9 mp -111.15 135.13 51.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.056 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -104.25 121.23 42.87 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.698 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.518 ' HD2' HD11 ' A' ' 79' ' ' LEU . 11.3 m-85 -99.85 142.24 31.59 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.084 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -131.69 125.54 32.33 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -148.86 117.67 6.66 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.686 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 58.0 31.47 20.68 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.456 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.87 -14.44 58.62 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.087 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -85.08 106.98 16.95 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 117.013 0.406 . . . . 0.0 110.378 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -101.21 144.07 30.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.013 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -143.01 157.94 44.07 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.364 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.43 HG21 ' HE ' ' A' ' 5' ' ' ARG . 3.8 mp -115.98 123.07 70.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.821 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 30.9 mt -130.86 138.63 53.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.181 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.24 133.97 34.59 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.125 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -128.13 117.63 21.96 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 97.6 p -76.21 145.89 39.46 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.126 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -98.91 154.52 37.32 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.032 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.34 120.71 7.14 Favored 'Cis proline' 0 C--N 1.351 0.704 0 C-N-CA 123.335 -1.527 . . . . 0.0 112.796 0.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -75.57 129.46 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.266 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.422 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -97.73 139.29 33.82 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.973 -179.941 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -55.31 -44.25 75.62 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.765 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.71 -41.15 94.66 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.924 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.4 -44.44 96.43 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.116 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 24' ' ' LYS . 22.2 t -65.88 -48.63 81.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.823 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -58.44 -39.97 81.3 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.241 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -40.24 80.25 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.754 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.68 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.4 OUTLIER -68.54 -48.13 65.11 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.993 179.515 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 28' ' ' VAL . 23.2 t -60.02 -42.62 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.344 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.6 m -61.37 -39.0 89.04 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.924 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.9 m -71.49 -46.98 58.34 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 111.47 0.174 . . . . 0.0 111.47 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 31' ' ' LYS . 36.8 t -58.27 -50.05 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.474 ' CE2' HD13 ' A' ' 79' ' ' LEU . 24.9 m-85 -83.6 -24.67 31.39 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.17 28.25 58.59 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.848 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.503 ' O ' HD12 ' A' ' 40' ' ' LEU . 1.5 pt20 -173.08 159.63 3.49 Favored Pre-proline 0 N--CA 1.464 0.226 0 CA-C-N 116.712 0.256 . . . . 0.0 110.973 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.433 ' HD2' ' HB2' ' A' ' 38' ' ' GLN . 56.3 Cg_endo -71.23 109.73 2.66 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.631 2.221 . . . . 0.0 112.524 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.503 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.9 mp -115.59 154.82 28.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.091 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -98.17 141.9 30.52 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.779 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.443 ' N ' HD23 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -108.49 100.06 9.38 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.695 179.783 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.0 m170 -92.14 131.04 37.7 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.418 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -107.03 121.94 45.46 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.486 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 7.7 mmt -109.32 114.75 28.69 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.62 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -72.3 -56.58 5.26 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.734 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -170.77 -58.6 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.574 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -117.44 2.57 12.45 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.676 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.709 HD12 HD11 ' A' ' 51' ' ' ILE . 0.5 OUTLIER -131.76 159.59 38.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.784 0.326 . . . . 0.0 111.659 -179.851 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.87 125.08 49.84 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.262 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.709 HD11 HD12 ' A' ' 49' ' ' LEU . 28.0 mm -116.14 132.11 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.851 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -96.33 126.82 41.8 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.817 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.496 HD21 ' HA ' ' A' ' 59' ' ' LEU . 7.0 mt -87.56 92.11 8.98 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.761 0.315 . . . . 0.0 110.764 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.9 pttt -107.46 -34.38 7.07 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.416 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -131.54 171.04 13.9 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.712 0.291 . . . . 0.0 111.033 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -31.54 71.19 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.922 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -54.09 -44.77 71.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.664 0.269 . . . . 0.0 111.029 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.446 ' HB2' HD23 ' A' ' 53' ' ' LEU . 61.1 m-20 -67.21 -36.76 82.4 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.809 179.555 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.496 ' HA ' HD21 ' A' ' 53' ' ' LEU . 1.3 tp -68.86 -41.85 77.87 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.095 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.58 -41.1 96.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.066 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -62.99 -39.21 94.07 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.847 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.3 -43.67 97.17 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.078 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 43.9 mm -65.37 -41.49 91.34 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.826 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.48 -43.26 75.38 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.971 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.0 mt -67.83 -42.44 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.881 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.9 tp -67.36 -39.23 85.69 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.399 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.57 -37.51 86.45 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.695 0.283 . . . . 0.0 110.924 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -32.37 62.78 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.511 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.3 p -78.48 119.45 21.8 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.03 0.443 . . . . 0.0 111.162 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.49 -29.5 56.85 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.674 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.1 p -93.67 34.58 1.18 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 120.634 0.254 . . . . 0.0 111.678 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.5 mtm -149.98 123.21 8.93 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.667 0.27 . . . . 0.0 111.022 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.55 -46.97 2.35 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.684 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.1 t -83.65 174.09 10.81 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.951 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.629 ' HB2' HG23 ' A' ' 6' ' ' ILE . 2.3 mp -119.07 135.29 54.72 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.903 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.9 mtt85 -102.0 107.49 18.63 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.727 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 9.0 mt -129.58 131.79 66.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.868 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.07 119.48 38.86 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.604 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.518 HD11 ' HD2' ' A' ' 8' ' ' PHE . 2.6 mt -93.42 129.44 39.57 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.116 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mp -138.58 134.95 34.47 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.086 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.466 0.344 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.96 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.466 0.333 0 CA-C-O 120.817 0.341 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -75.46 143.68 12.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.075 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.4 mtp85 -95.36 114.65 26.44 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.769 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.729 HD13 ' HD2' ' A' ' 19' ' ' PHE . 4.6 mp -115.4 134.74 57.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.269 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.69 127.47 47.09 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.785 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -107.46 138.46 43.63 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.059 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -130.47 124.18 31.41 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.105 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.54 ' HB2' HD12 ' A' ' 79' ' ' LEU . 1.0 OUTLIER -147.06 127.91 14.42 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.633 179.906 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.08 27.68 16.71 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.489 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.45 -13.98 60.78 Favored Glycine 0 CA--C 1.526 0.728 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.13 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -83.04 163.44 20.96 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 117.004 0.402 . . . . 0.0 111.119 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.1 mtt180 -120.65 153.03 37.42 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.251 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.1 141.15 28.55 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.02 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mt -111.73 119.02 59.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.877 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.16 130.34 34.24 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 120.925 0.393 . . . . 0.0 111.218 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.57 135.68 40.62 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.055 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.729 ' HD2' HD13 ' A' ' 6' ' ' ILE . 39.2 m-85 -122.93 126.65 47.65 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.11 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.3 m -72.63 138.56 46.81 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.015 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.26 152.68 38.71 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.964 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.2 132.31 26.89 Favored 'Cis proline' 0 C--N 1.349 0.594 0 C-N-CA 123.275 -1.552 . . . . 0.0 112.726 0.223 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -110.65 130.45 63.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.118 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.71 144.91 25.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.014 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -54.71 -37.4 65.81 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.193 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -59.35 -45.07 92.41 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.046 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.47 -44.21 95.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.105 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.494 ' O ' HG23 ' A' ' 32' ' ' VAL . 22.4 t -65.43 -48.82 81.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.891 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -56.68 -41.42 77.29 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.839 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -57.67 -42.32 83.33 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.737 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.642 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -66.8 -47.64 71.47 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.131 179.595 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 28' ' ' VAL . 25.5 t -57.53 -45.65 86.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.138 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.9 m -62.66 -38.78 91.67 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.087 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.3 m -71.48 -46.91 58.59 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.3 t -60.68 -49.92 82.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.702 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 35.4 m-85 -83.84 -21.96 31.87 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.54 -16.74 60.09 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 120.735 -0.745 . . . . 0.0 113.06 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.607 ' O ' HD12 ' A' ' 40' ' ' LEU . 11.5 pt20 -146.11 158.0 49.0 Favored Pre-proline 0 CA--C 1.531 0.227 0 CA-C-N 116.846 0.323 . . . . 0.0 110.758 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.99 129.61 14.46 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.573 2.182 . . . . 0.0 112.489 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.607 HD12 ' O ' ' A' ' 38' ' ' GLN . 4.7 mp -120.86 151.91 39.06 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.36 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.24 137.64 32.17 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.611 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.522 HD22 HG21 ' A' ' 77' ' ' ILE . 3.1 mt -98.76 107.03 19.37 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.942 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.457 ' CE1' HD13 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -93.75 114.89 27.27 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.048 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -95.12 129.07 42.36 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 21.8 ptm -127.11 121.63 31.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.712 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -86.34 -60.05 2.11 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.358 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.12 -67.97 0.14 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.273 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.59 -21.39 12.15 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.683 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mp -104.65 140.38 38.12 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.768 0.318 . . . . 0.0 111.311 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.91 122.36 46.75 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.827 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.5 mt -113.95 132.52 62.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.83 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.457 HD13 ' CE1' ' A' ' 43' ' ' HIS . 31.2 tp -93.3 134.84 35.1 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.759 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 56.1 mt -87.37 107.57 18.59 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.997 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.57 -35.72 6.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.306 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -136.87 180.0 6.04 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.39 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.405 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 4.8 tp60 -64.32 -34.33 77.88 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.122 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.04 -40.35 73.36 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.796 -0.183 . . . . 0.0 111.283 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -66.36 -50.02 64.96 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.422 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.466 HD12 ' N ' ' A' ' 60' ' ' ASP . 3.9 pp -69.79 -34.38 73.65 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.968 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.78 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.2 t0 -61.31 -43.76 98.33 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.62 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -70.22 -32.75 70.77 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.07 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.821 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.81 -39.32 93.94 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.319 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.78 HD12 ' HA ' ' A' ' 60' ' ' ASP . 5.8 mt -61.08 -47.37 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.736 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -53.18 -37.32 61.81 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.157 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.821 HD12 ' HA ' ' A' ' 62' ' ' ALA . 17.0 mt -64.91 -38.38 82.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.067 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.52 HD11 ' HG ' ' A' ' 75' ' ' LEU . 14.5 mt -66.55 -46.99 74.26 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.984 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.12 -38.16 85.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.199 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -28.74 67.91 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.47 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.1 p -62.44 165.83 5.74 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.956 0.407 . . . . 0.0 111.519 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.88 -43.16 18.56 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.198 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 57.6 p -127.62 -35.06 2.16 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.223 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -50.45 91.45 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.181 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -106.73 -32.35 8.02 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.168 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.6 p -69.12 -179.85 1.68 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.63 0.252 . . . . 0.0 111.09 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.553 ' HB3' HD11 ' A' ' 77' ' ' ILE . 3.1 mp -129.69 117.64 20.65 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.723 0.297 . . . . 0.0 111.525 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -86.89 106.89 18.08 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.246 179.356 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.553 HD11 ' HB3' ' A' ' 75' ' ' LEU . 2.6 mt -129.78 130.8 66.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.111 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -103.9 129.61 51.44 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.578 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.702 HD13 ' CZ ' ' A' ' 36' ' ' PHE . 4.9 mt -93.63 129.11 40.02 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.25 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.419 HD12 ' C ' ' A' ' 79' ' ' LEU . 5.8 mp -138.3 134.08 33.86 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.072 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.7 m . . . . . 0 N--CA 1.463 0.219 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.297 -179.79 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.771 0.319 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.28 138.99 52.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.148 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.61 113.73 25.22 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.031 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.481 HD12 ' CD2' ' A' ' 19' ' ' PHE . 21.3 mt -104.93 117.44 50.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.974 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -98.41 127.16 44.22 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.022 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.753 ' CD1' HD12 ' A' ' 17' ' ' ILE . 33.5 m-85 -110.71 147.87 33.48 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.025 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -129.56 132.76 46.91 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.223 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' HIS . . . . . 0.449 ' HB2' HD11 ' A' ' 79' ' ' LEU . 12.3 t-80 -148.19 112.97 5.41 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.812 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 56.39 36.74 28.02 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.396 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.43 -13.96 62.42 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.218 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -84.34 122.01 28.33 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.984 0.392 . . . . 0.0 110.812 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -105.38 146.03 29.99 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.135 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.57 138.51 24.76 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.136 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.2 mp -105.75 122.1 58.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.999 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.753 HD12 ' CD1' ' A' ' 8' ' ' PHE . 6.1 mt -126.27 127.45 70.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.923 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.3 140.76 29.38 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.315 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.481 ' CD2' HD12 ' A' ' 6' ' ' ILE . 8.0 m-85 -137.35 119.85 15.97 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.76 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.0 m -75.63 134.62 40.59 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.081 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.401 ' HA ' ' N ' ' A' ' 23' ' ' VAL . 7.3 mtm180 -75.77 150.42 83.98 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.226 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.06 120.76 7.33 Favored 'Cis proline' 0 C--N 1.349 0.577 0 C-N-CA 123.284 -1.549 . . . . 0.0 112.283 -0.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.401 ' N ' ' HA ' ' A' ' 21' ' ' ARG . 12.6 p -73.77 127.66 35.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.983 0.42 . . . . 0.0 110.993 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.97 130.57 46.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.945 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -55.87 -35.99 67.09 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.997 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.19 -44.49 96.49 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.152 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -66.26 -44.8 82.63 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.703 0.287 . . . . 0.0 111.006 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.1 t -67.16 -46.51 84.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.95 179.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -61.4 -42.51 98.84 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.304 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -58.16 -41.87 84.73 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.011 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.776 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -61.14 -46.98 88.31 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.881 179.602 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.0 t -66.25 -45.55 89.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.12 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.1 m -60.09 -38.71 83.74 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.1 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 59.7 m -70.61 -43.58 69.02 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 31' ' ' LYS . 62.1 t -58.47 -49.87 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-O 120.526 0.203 . . . . 0.0 111.311 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -83.7 -28.13 28.51 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.04 28.49 34.1 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.668 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.588 ' O ' HD12 ' A' ' 40' ' ' LEU . 8.9 pt20 -168.94 158.4 7.72 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-O 120.535 0.207 . . . . 0.0 110.899 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.03 124.7 10.79 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.943 2.429 . . . . 0.0 112.217 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.627 HD22 HD13 ' A' ' 79' ' ' LEU . 4.0 mp -117.21 151.54 36.68 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.175 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.25 120.99 40.75 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.928 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.633 HD23 HG21 ' A' ' 77' ' ' ILE . 4.0 mp -83.52 125.88 32.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.13 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -113.67 115.57 28.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -111.67 121.85 46.22 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.696 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -115.52 133.27 56.19 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.757 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -74.17 -56.18 5.21 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.77 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -170.04 -57.57 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.39 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.64 -30.32 10.04 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.316 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.6 mt -108.89 145.31 35.57 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.968 0.413 . . . . 0.0 111.389 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 30.2 t -109.78 127.98 55.0 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.952 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.9 mt -118.42 134.44 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.978 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.602 HD22 ' HG2' ' A' ' 54' ' ' LYS . 2.1 tt -90.69 128.98 36.83 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.841 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.569 HD12 ' HB3' ' A' ' 42' ' ' LEU . 47.5 mt -81.33 96.96 7.48 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.962 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.602 ' HG2' HD22 ' A' ' 52' ' ' LEU . 5.9 mmtp -108.72 -37.85 5.79 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.226 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -125.96 175.81 7.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.099 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.411 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 2.6 mt-30 -62.97 -32.63 74.01 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.904 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.25 -39.12 72.07 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.353 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.482 ' HB3' HD23 ' A' ' 53' ' ' LEU . 9.2 m-20 -64.16 -50.43 68.2 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.495 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.421 HD12 ' C ' ' A' ' 59' ' ' LEU . 3.6 pp -71.75 -34.45 69.51 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.086 -0.246 . . . . 0.0 110.926 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -63.01 -43.25 99.29 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.786 0.326 . . . . 0.0 111.027 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -33.26 73.71 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.91 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.96 99.69 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.257 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.639 ' HA ' HD12 ' A' ' 66' ' ' LEU . 16.0 mt -63.88 -42.58 96.31 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.737 179.57 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -54.35 -41.83 69.55 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.872 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 29.2 mt -66.7 -41.04 87.48 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.983 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.715 HD13 HD11 ' A' ' 75' ' ' LEU . 6.0 mt -65.19 -40.32 94.07 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.113 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -66.75 -32.02 73.04 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.171 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -33.77 76.57 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.48 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.7 t -104.76 134.22 48.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.452 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 94.3 p -77.33 -37.29 52.76 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.989 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.5 p -63.27 -35.85 81.7 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.135 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.07 121.49 27.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.698 0.285 . . . . 0.0 111.068 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -132.17 -52.61 0.96 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.996 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.2 m -70.01 177.94 2.95 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.134 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.715 HD11 HD13 ' A' ' 66' ' ' LEU . 1.1 mp -131.9 119.03 20.61 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.157 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -96.65 107.02 19.39 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.32 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.633 HG21 HD23 ' A' ' 42' ' ' LEU . 29.5 mt -128.69 132.19 67.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.904 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.6 mp -102.08 130.72 48.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.626 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.627 HD13 HD22 ' A' ' 40' ' ' LEU . 2.0 pp -117.86 136.05 53.7 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.958 0.409 . . . . 0.0 111.215 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mp -137.74 158.45 44.34 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.944 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.9 t . . . . . 0 C--O 1.233 0.207 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.099 179.885 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.242 0 CA-C-O 120.807 0.336 . . . . 0.0 111.236 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.407 ' O ' HD12 ' A' ' 6' ' ' ILE . 22.2 t -101.56 129.33 52.88 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.783 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -90.6 105.58 17.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.056 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.518 HD13 ' HD2' ' A' ' 19' ' ' PHE . 3.5 mp -114.99 129.07 71.8 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.208 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.4 mtpt -100.34 126.81 46.73 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.634 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.485 ' HB3' HD11 ' A' ' 79' ' ' LEU . 48.7 m-85 -114.89 127.56 55.77 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.022 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -122.0 131.2 53.87 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.217 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -145.5 128.73 16.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.694 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.73 30.67 20.25 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.221 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.96 -13.96 59.95 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.982 -0.628 . . . . 0.0 113.065 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.33 116.57 28.4 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 117.001 0.401 . . . . 0.0 110.848 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -104.93 135.87 45.48 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.233 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -134.2 154.27 51.35 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.248 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.413 ' O ' HD13 ' A' ' 17' ' ' ILE . 7.4 mt -115.31 122.25 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.344 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.413 HD13 ' O ' ' A' ' 16' ' ' ILE . 26.4 mm -127.49 128.66 70.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.145 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.91 129.05 36.32 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.694 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.518 ' HD2' HD13 ' A' ' 6' ' ' ILE . 11.9 m-85 -117.34 117.61 29.99 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.386 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.02 157.14 38.07 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.173 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.556 ' NH2' HG21 ' A' ' 63' ' ' ILE . 5.9 mmt180 -99.84 151.31 37.44 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.469 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.35 145.11 81.25 Favored 'Cis proline' 0 C--N 1.35 0.608 0 C-N-CA 123.414 -1.494 . . . . 0.0 112.801 0.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.6 p -107.42 124.49 63.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.106 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' O ' HG23 ' A' ' 28' ' ' VAL . 18.7 mmtm -102.56 149.88 23.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.236 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -58.11 -48.17 81.03 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.757 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.35 -42.28 95.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.227 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -62.08 -44.33 96.9 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.059 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' ' 24' ' ' LYS . 38.3 t -68.83 -48.72 69.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.785 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -40.06 84.62 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.2 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -58.18 -39.89 80.07 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.816 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -70.97 -41.03 71.57 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.752 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 28' ' ' VAL . 37.8 t -66.64 -42.58 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.186 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 t -65.71 -38.5 89.36 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.146 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.9 m -71.31 -46.79 59.85 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.436 HG13 ' N ' ' A' ' 36' ' ' PHE . 13.4 p -60.38 -47.95 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 -179.412 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.661 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 33.1 m-85 -84.08 -18.09 38.08 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.43 22.63 64.46 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 120.865 -0.683 . . . . 0.0 113.118 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.518 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -172.26 149.87 2.22 Favored Pre-proline 0 N--CA 1.463 0.216 0 CA-C-N 116.863 0.331 . . . . 0.0 110.94 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -74.23 106.9 2.32 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.569 2.179 . . . . 0.0 112.125 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.2 mp -104.87 140.04 38.73 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.96 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.47 140.75 41.36 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.017 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.661 ' HB2' HD12 ' A' ' 53' ' ' LEU . 3.3 mp -101.95 118.52 37.08 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.062 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -105.3 129.69 53.59 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.299 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -109.79 129.01 55.67 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.656 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.1 mtt -125.48 132.41 52.66 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.682 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -97.61 -65.83 0.94 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.686 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -144.87 -71.51 0.27 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.442 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -111.58 -18.23 12.86 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.527 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.3 mp -105.63 139.96 39.43 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.803 0.335 . . . . 0.0 111.35 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.8 m -114.03 125.8 54.4 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.828 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.1 mt -114.0 132.54 62.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.099 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.644 HD22 ' HE2' ' A' ' 54' ' ' LYS . 8.6 tt -92.38 128.08 38.1 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.8 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.834 HD13 HD21 ' A' ' 59' ' ' LEU . 71.9 mt -71.51 100.03 2.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.564 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.644 ' HE2' HD22 ' A' ' 52' ' ' LEU . 5.5 mmtt -90.2 -49.25 6.66 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.424 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -149.06 -170.2 3.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.869 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.69 -32.34 65.34 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.255 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -53.76 -45.66 70.69 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.849 0.357 . . . . 0.0 110.799 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.03 -42.69 84.43 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.166 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.834 HD21 HD13 ' A' ' 53' ' ' LEU . 77.5 mt -67.82 -40.53 83.78 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.272 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.776 ' HA ' HD12 ' A' ' 63' ' ' ILE . 3.0 t0 -61.66 -43.46 98.81 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.06 -179.575 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -63.39 -39.4 94.41 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.388 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.64 98.93 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.188 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.776 HD12 ' HA ' ' A' ' 60' ' ' ASP . 6.2 mt -63.78 -45.73 96.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.883 179.708 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -44.85 78.32 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.041 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.3 mt -67.09 -39.48 83.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.989 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.857 HD22 HD21 ' A' ' 75' ' ' LEU . 9.4 tp -61.99 -45.45 93.59 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.057 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -56.92 -37.24 71.2 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.256 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -33.24 64.62 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.101 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.3 t -89.07 92.68 9.31 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.256 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 40.6 t -62.99 -34.75 78.2 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.054 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.06 -33.78 67.6 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.318 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.96 129.42 42.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.097 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 47.5 mttt -111.71 -44.69 3.45 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.887 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.472 ' C ' HD22 ' A' ' 75' ' ' LEU . 60.5 p -101.62 179.04 4.46 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.187 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.857 HD21 HD22 ' A' ' 66' ' ' LEU . 4.0 mm? -123.25 128.93 50.68 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.062 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -88.47 108.57 19.45 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.654 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.9 mt -127.26 131.3 70.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.189 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -102.02 128.29 48.52 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.699 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.661 HD13 ' CZ ' ' A' ' 36' ' ' PHE . 2.5 mt -94.02 122.35 36.43 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.148 -179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.1 mp -134.1 134.24 42.04 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.114 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.233 0.186 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.996 -179.774 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 . . . . . 0 N--CA 1.469 0.509 0 CA-C-O 120.81 0.338 . . . . 0.0 111.342 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.4 t -99.59 131.58 46.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.208 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -88.96 119.93 29.92 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.746 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.5 mt -115.66 133.63 61.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.192 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.8 mttp -99.43 125.0 45.07 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.834 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -114.11 137.22 52.02 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.182 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.48 133.36 55.42 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.392 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -146.13 116.8 7.62 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.265 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 57.97 33.99 23.8 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.391 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.24 13.31 80.98 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 121.029 -0.605 . . . . 0.0 113.348 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -109.49 120.36 42.27 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 117.237 0.519 . . . . 0.0 110.518 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -92.75 135.21 34.31 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.978 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.38 143.39 50.74 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.036 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.422 ' O ' HD13 ' A' ' 17' ' ' ILE . 3.6 mt -110.12 116.02 51.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.199 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.422 HD13 ' O ' ' A' ' 16' ' ' ILE . 26.3 mm -128.36 131.46 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.046 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.47 129.88 36.59 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.007 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -127.15 118.38 24.23 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.934 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.95 145.08 34.21 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.972 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -99.85 149.56 36.06 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.171 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.77 121.65 7.95 Favored 'Cis proline' 0 C--N 1.35 0.655 0 C-N-CA 123.361 -1.516 . . . . 0.0 112.899 0.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.7 p -89.86 130.48 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.855 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -84.09 138.25 33.14 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.126 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -55.99 -45.04 79.13 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.234 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.57 -39.62 80.82 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.938 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -63.4 -44.59 94.24 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.047 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 32' ' ' VAL . 21.5 t -67.87 -48.88 73.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.016 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -41.18 96.08 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.503 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -45.39 87.38 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.766 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.651 ' O ' HG23 ' A' ' 35' ' ' VAL . 1.4 tptm -61.59 -47.58 84.84 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.769 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.58 HG11 HD22 ' A' ' 79' ' ' LEU . 39.1 t -58.93 -48.9 84.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-O 120.668 0.271 . . . . 0.0 110.964 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.4 m -64.28 -39.03 93.11 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.472 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.3 m -71.82 -48.19 48.01 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 31' ' ' LYS . 65.5 t -60.85 -48.83 87.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 -179.271 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.439 ' CE2' HD13 ' A' ' 79' ' ' LEU . 52.5 m-85 -83.28 -22.09 33.11 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.67 -7.73 81.13 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.887 -0.673 . . . . 0.0 113.34 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.669 ' O ' HD12 ' A' ' 40' ' ' LEU . 16.1 mt-30 -131.67 145.57 58.09 Favored Pre-proline 0 CA--C 1.529 0.152 0 CA-C-N 117.279 0.539 . . . . 0.0 110.984 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -75.06 94.4 0.96 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.57 2.18 . . . . 0.0 112.211 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.669 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.6 mp -94.68 135.98 35.52 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.888 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.577 ' CG ' HD11 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -76.16 140.47 41.75 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.962 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 mt -87.3 100.19 12.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.596 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.521 ' CE1' HD13 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -95.44 117.76 30.95 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.497 -179.382 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -107.07 115.94 31.06 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.361 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.4 ptm -101.3 134.88 43.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.77 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -89.62 -45.46 9.34 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.87 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -173.16 -68.36 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.43 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -108.99 -24.5 11.18 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.505 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 mp -105.03 137.94 42.0 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.789 0.328 . . . . 0.0 111.302 -179.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 p -95.62 124.42 39.64 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.596 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.7 134.37 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.735 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.577 HD11 ' CG ' ' A' ' 41' ' ' ASP . 14.0 tp -102.74 130.84 49.82 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.743 0.306 . . . . 0.0 110.957 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.467 HD21 ' HA ' ' A' ' 59' ' ' LEU . 8.1 mt -78.07 93.35 4.49 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.852 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.15 -37.46 12.1 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.155 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -134.83 171.55 14.22 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.835 0.35 . . . . 0.0 111.337 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.1 tp60 -60.72 -31.61 70.9 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.363 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -52.97 -45.86 67.99 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.773 0.321 . . . . 0.0 110.506 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.439 ' HB3' HD23 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -63.16 -39.47 94.76 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.239 179.591 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.467 ' HA ' HD21 ' A' ' 53' ' ' LEU . 17.7 tp -66.29 -42.98 87.58 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.143 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.596 ' HA ' HD12 ' A' ' 63' ' ' ILE . 3.3 m-20 -61.49 -43.12 99.43 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.836 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.66 -40.63 97.68 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.469 179.11 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.42 -42.93 99.81 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.666 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.596 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.7 mt -63.3 -44.17 99.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 120.521 0.2 . . . . 0.0 110.834 179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -55.79 -43.73 77.1 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.253 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.6 mt -68.87 -41.74 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.933 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.478 HD13 ' HG ' ' A' ' 75' ' ' LEU . 1.5 tp -60.68 -45.05 95.64 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.012 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -58.62 -41.74 86.63 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.996 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.0 ttp85 -71.29 -33.57 69.84 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.611 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.2 p -82.57 103.03 11.8 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.847 0.356 . . . . 0.0 111.284 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 59.8 m -77.91 -38.2 46.2 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.281 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 p -61.96 -33.22 73.88 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.607 0.241 . . . . 0.0 111.562 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.0 tpt -63.17 150.29 43.27 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.99 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.34 105.25 8.41 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.705 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.9 m 66.04 -178.56 0.19 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.097 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.478 ' HG ' HD13 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -98.84 123.42 43.08 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.95 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.33 107.14 18.99 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.835 0.35 . . . . 0.0 110.633 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.6 mt -128.1 131.16 69.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.805 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -102.0 124.65 47.98 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.555 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.58 HD22 HG11 ' A' ' 32' ' ' VAL . 14.5 mt -93.63 133.28 37.13 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.211 -179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.439 HD21 ' ND1' ' A' ' 43' ' ' HIS . 0.4 OUTLIER -140.21 136.16 33.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.367 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.371 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.492 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 . . . . . 0 N--CA 1.468 0.449 0 CA-C-O 120.886 0.374 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -87.18 135.31 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.263 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.2 mtm-85 -92.93 124.5 36.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.913 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.508 HD12 ' HD1' ' A' ' 19' ' ' PHE . 2.8 mt -113.62 136.79 48.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.151 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -95.65 119.74 34.69 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.864 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.676 ' CD2' HD21 ' A' ' 79' ' ' LEU . 20.5 m-85 -107.71 136.69 47.03 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.907 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -127.42 132.1 50.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.826 0.346 . . . . 0.0 111.551 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.7 t-160 -144.58 123.89 13.03 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.55 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 57.5 35.09 25.46 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.062 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 84.01 -14.19 45.06 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.464 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.83 149.26 37.91 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 117.193 0.497 . . . . 0.0 111.198 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -110.44 135.17 51.55 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.058 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -140.8 143.03 34.61 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.739 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.0 mt -118.06 118.13 57.16 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.996 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.4 mp -126.65 127.02 69.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.242 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.9 146.44 23.75 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.118 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.508 ' HD1' HD12 ' A' ' 6' ' ' ILE . 53.8 m-85 -135.27 134.66 40.18 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.064 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -81.72 125.77 31.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.906 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 ptt180 -93.46 153.46 41.37 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.059 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.1 119.62 6.32 Favored 'Cis proline' 0 C--N 1.351 0.703 0 C-N-CA 123.429 -1.488 . . . . 0.0 112.838 0.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -99.88 130.44 48.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.017 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.6 143.12 31.24 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.779 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -57.1 -36.17 70.31 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.926 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -59.18 -44.76 92.17 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.717 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.72 -40.39 95.25 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.9 t -67.8 -49.01 73.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.114 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -59.32 -39.79 84.23 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.927 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -40.71 89.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.823 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.731 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -66.04 -48.21 71.83 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.223 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 44.1 t -59.69 -43.62 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.245 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.6 m -60.66 -38.98 86.66 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.951 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.7 m -71.76 -44.45 64.03 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 111.461 0.171 . . . . 0.0 111.461 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 31' ' ' LYS . 34.5 t -59.52 -50.18 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-O 120.49 0.186 . . . . 0.0 111.444 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.513 ' CE2' HD13 ' A' ' 79' ' ' LEU . 34.1 m-85 -83.71 -26.57 29.67 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -179.791 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.24 -11.13 61.84 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.926 -0.654 . . . . 0.0 113.145 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.451 ' O ' HD12 ' A' ' 40' ' ' LEU . 1.6 mp0 -141.54 156.96 66.46 Favored Pre-proline 0 N--CA 1.465 0.283 0 CA-C-N 116.978 0.389 . . . . 0.0 110.702 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.401 ' HD2' ' HB3' ' A' ' 38' ' ' GLN . 56.6 Cg_endo -71.16 111.68 3.13 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.586 2.191 . . . . 0.0 112.524 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.451 HD12 ' O ' ' A' ' 38' ' ' GLN . 6.4 mp -101.68 157.92 16.48 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -99.89 138.05 37.5 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.968 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.601 HD23 HG21 ' A' ' 77' ' ' ILE . 3.7 mp -91.79 112.63 24.63 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.994 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -103.05 111.81 24.34 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.117 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.549 ' HE2' HD12 ' A' ' 75' ' ' LEU . 13.6 t80 -104.35 117.44 34.19 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.591 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 6.4 mtp -123.49 126.53 46.9 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.824 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -74.0 -59.59 2.65 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.43 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -170.22 -54.75 0.02 OUTLIER 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.431 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -104.32 -31.82 9.37 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.498 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.5 mp -108.76 144.25 36.83 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.79 0.328 . . . . 0.0 111.329 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.2 m -113.59 123.48 50.07 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.994 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -114.53 133.35 60.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.916 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.0 tt -93.65 124.73 37.84 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.982 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.83 HD23 ' HB3' ' A' ' 58' ' ' ASP . 4.2 mt -75.89 94.44 3.35 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.454 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -85.47 -34.31 21.65 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.416 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -160.51 -169.83 2.58 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.776 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -61.2 -29.82 70.04 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.493 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.95 -47.08 68.37 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.795 0.331 . . . . 0.0 110.725 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.83 ' HB3' HD23 ' A' ' 53' ' ' LEU . 1.7 t70 -67.64 -40.47 84.59 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.004 179.441 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 tp -66.8 -37.47 84.61 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.277 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.834 ' HA ' HD12 ' A' ' 63' ' ' ILE . 4.5 t70 -61.18 -42.79 99.19 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.12 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.92 -35.64 80.46 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.613 179.4 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -37.36 86.84 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.055 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.834 HD12 ' HA ' ' A' ' 60' ' ' ASP . 7.9 mt -63.83 -40.76 90.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.956 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -53.31 -45.39 68.96 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.864 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.7 mt -69.04 -36.38 73.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.115 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.941 HD22 HD21 ' A' ' 75' ' ' LEU . 22.1 tp -68.91 -41.98 77.48 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.87 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -62.42 -42.39 99.41 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.218 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.2 ptm85 -71.66 -30.46 65.75 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.553 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.7 p -88.99 108.95 19.86 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.892 0.377 . . . . 0.0 111.052 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.2 m -76.07 -34.61 59.57 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.23 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 81.5 p -63.81 -35.0 79.18 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.348 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.8 tpp -84.54 158.67 20.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.959 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.3 tttt -145.6 -54.8 0.29 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.084 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . 0.51 ' C ' HD22 ' A' ' 75' ' ' LEU . 78.7 p -93.08 173.9 7.5 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.827 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.941 HD21 HD22 ' A' ' 66' ' ' LEU . 3.8 mm? -122.88 131.04 53.57 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.991 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.427 ' O ' HD13 ' A' ' 77' ' ' ILE . 11.2 mtm180 -86.55 109.21 18.96 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.984 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.601 HG21 HD23 ' A' ' 42' ' ' LEU . 17.4 mm -124.88 132.38 71.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.088 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.632 HD23 HD11 ' A' ' 80' ' ' LEU . 3.5 tp -101.97 131.52 48.33 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.554 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.676 HD21 ' CD2' ' A' ' 8' ' ' PHE . 1.3 mt -102.19 119.68 39.2 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.051 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.632 HD11 HD23 ' A' ' 78' ' ' LEU . 2.2 mp -141.3 145.39 35.44 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.678 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.4 t . . . . . 0 C--O 1.234 0.239 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.951 179.934 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.41 ' HA ' ' HA ' ' A' ' 20' ' ' SER . 8.4 t0 . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.884 0.373 . . . . 0.0 110.597 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.7 t -99.97 127.37 52.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.959 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.92 121.76 29.85 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.891 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.538 HD12 ' CD2' ' A' ' 19' ' ' PHE . 31.1 mt -111.61 130.08 65.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.965 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -103.72 113.3 26.72 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.734 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.674 ' HB3' HD11 ' A' ' 79' ' ' LEU . 64.5 m-85 -97.14 143.95 27.45 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.088 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -135.59 127.55 29.55 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.197 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -147.85 118.14 7.35 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.552 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 58.74 35.31 24.3 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.095 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.01 6.79 89.22 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 120.949 -0.643 . . . . 0.0 113.249 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -100.59 111.09 23.29 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 117.162 0.481 . . . . 0.0 110.792 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.3 ptt85 -94.64 141.66 28.35 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.197 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.4 mtt85 -143.72 141.24 30.39 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.054 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 21.8 mt -112.62 128.0 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.185 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.113 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.7 mp -134.07 137.82 51.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.226 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.8 135.85 33.45 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.073 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.538 ' CD2' HD12 ' A' ' 6' ' ' ILE . 75.0 m-85 -135.67 116.84 14.44 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.148 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' ASP . 0.3 OUTLIER -93.14 135.24 34.51 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.975 179.692 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mtt180 -78.55 155.73 78.52 Favored Pre-proline 0 N--CA 1.463 0.193 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.933 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.93 125.56 11.46 Favored 'Cis proline' 0 C--N 1.35 0.64 0 C-N-CA 123.406 -1.498 . . . . 0.0 112.494 -0.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.0 p -108.04 128.5 63.37 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.004 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.4 mttt -92.83 143.22 26.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.166 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.401 ' HB2' ' HG2' ' A' ' 56' ' ' GLN . 72.4 t80 -56.48 -39.44 73.23 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.833 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -64.73 -39.38 93.54 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.937 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -44.19 96.94 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.935 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.66 ' O ' HG23 ' A' ' 32' ' ' VAL . 21.9 t -68.73 -48.04 73.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.051 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -59.99 -40.04 87.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.145 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.48 -39.99 81.49 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.665 179.492 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.702 ' O ' HG23 ' A' ' 35' ' ' VAL . 14.8 tttt -69.13 -46.56 67.34 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.45 179.242 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 28' ' ' VAL . 18.0 t -59.76 -48.52 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.399 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -60.77 -38.46 85.33 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.491 -179.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 60.8 m -69.83 -45.39 67.93 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.682 0.252 . . . . 0.0 111.682 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.9 t -60.02 -49.27 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.492 0.186 . . . . 0.0 111.352 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.715 ' CE2' HD13 ' A' ' 79' ' ' LEU . 27.1 m-85 -80.96 -23.6 38.67 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.722 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.2 19.64 76.65 Favored Glycine 0 CA--C 1.523 0.574 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.908 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.485 ' O ' HD12 ' A' ' 40' ' ' LEU . 13.1 mt-30 -155.92 148.36 17.74 Favored Pre-proline 0 C--O 1.233 0.217 0 CA-C-N 116.792 0.296 . . . . 0.0 111.005 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.35 104.29 1.83 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.701 2.267 . . . . 0.0 112.325 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.485 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.2 mp -109.23 138.32 45.77 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.059 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -81.22 138.42 35.79 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.064 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.2 mp -90.61 120.66 31.86 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.871 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -108.27 116.76 32.56 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.235 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.535 ' HB2' HD11 ' A' ' 53' ' ' LEU . 17.7 t80 -110.32 120.36 42.17 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.83 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -130.44 135.58 48.14 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.831 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -77.4 -62.55 1.62 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.863 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.85 -53.69 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.366 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -104.5 -32.46 8.97 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.417 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.427 HD13 ' H ' ' A' ' 50' ' ' SER . 0.1 OUTLIER -106.49 137.32 44.69 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.692 0.282 . . . . 0.0 111.236 -179.725 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.427 ' H ' HD13 ' A' ' 49' ' ' LEU . 15.7 m -113.82 130.4 56.47 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.841 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.4 mt -124.01 133.01 70.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.195 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.2 tt -89.68 131.33 35.71 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.821 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.535 HD11 ' HB2' ' A' ' 44' ' ' TYR . 7.3 mt -87.58 103.85 15.95 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.896 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -109.12 -36.55 6.03 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.025 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -128.05 174.48 9.18 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.171 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.401 ' HG2' ' HB2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -62.56 -32.48 73.45 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.074 179.813 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -54.12 -41.54 68.45 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.034 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.518 ' HB3' HD23 ' A' ' 53' ' ' LEU . 7.8 m-20 -63.39 -47.5 81.79 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.012 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.06 -40.16 90.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.89 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.58 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.9 OUTLIER -62.05 -42.97 99.75 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.731 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.57 -33.39 74.92 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.961 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.44 -37.21 84.98 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.275 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.58 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.8 mt -65.77 -43.91 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.645 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.16 -45.36 91.21 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.079 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 26.3 mt -68.26 -41.42 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.091 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.2 tp -68.74 -39.81 80.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.165 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -62.48 -41.89 99.1 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.653 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.6 ptt180 -67.7 -26.99 66.45 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.622 0.249 . . . . 0.0 110.958 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.1 t -70.34 127.33 32.38 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.716 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.1 m -60.82 -37.08 80.77 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.421 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -65.57 0.66 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.196 -179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 9.9 ptt? 37.94 66.36 0.48 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.437 0.46 . . . . 0.0 111.846 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm -110.05 89.32 2.99 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.6 m 63.32 170.34 0.15 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.637 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.8 mp -110.33 122.69 48.29 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.102 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.63 107.44 19.43 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.648 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.9 mt -129.67 131.36 66.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.87 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.1 tp -101.9 126.87 48.89 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.617 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.715 HD13 ' CE2' ' A' ' 36' ' ' PHE . 3.5 mt -93.56 134.38 35.91 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.005 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 pp -150.95 144.09 24.72 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.987 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.2 m . . . . . 0 C--O 1.233 0.205 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.124 -179.919 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.403 0 CA-C-O 120.985 0.421 . . . . 0.0 111.483 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.1 t -139.85 123.51 18.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.204 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.2 108.39 19.27 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.571 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.486 HD12 ' CD2' ' A' ' 19' ' ' PHE . 22.8 mt -108.43 125.07 65.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.97 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -95.63 120.36 35.73 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.658 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.661 ' HD2' HD12 ' A' ' 17' ' ' ILE . 61.0 m-85 -113.1 127.41 56.19 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.66 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 14' ' ' ARG . 4.5 pt-20 -123.35 139.86 53.6 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.948 0.404 . . . . 0.0 111.429 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -137.89 114.44 10.41 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.451 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 61.22 38.14 16.89 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.125 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.09 -14.33 59.26 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.332 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.41 105.98 17.95 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 117.073 0.436 . . . . 0.0 110.783 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.403 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -91.44 156.23 17.87 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.073 -179.958 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.1 157.92 43.77 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.046 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.5 mt -114.64 120.29 63.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.661 HD12 ' HD2' ' A' ' 8' ' ' PHE . 11.7 mt -130.71 126.92 61.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.732 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.09 146.51 24.26 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.212 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.486 ' CD2' HD12 ' A' ' 6' ' ' ILE . 29.4 m-85 -138.46 132.84 31.93 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.049 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 p -81.36 165.9 20.93 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.201 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -110.25 143.87 28.95 Favored Pre-proline 0 CA--C 1.529 0.159 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.13 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.52 136.0 41.27 Favored 'Cis proline' 0 C--N 1.35 0.634 0 C-N-CA 123.362 -1.516 . . . . 0.0 112.576 -0.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.0 p -88.77 129.43 39.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.031 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.469 ' O ' HG23 ' A' ' 28' ' ' VAL . 71.2 mmtt -100.49 130.71 46.6 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -54.73 -45.26 74.09 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.113 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -58.76 -42.44 88.91 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.049 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -62.88 -44.26 96.57 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.005 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 24' ' ' LYS . 24.5 t -64.69 -48.24 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.874 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.09 -36.48 81.83 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.014 179.575 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -58.36 -36.91 74.18 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.13 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.678 ' O ' HG23 ' A' ' 35' ' ' VAL . 3.8 mttt -72.91 -47.92 41.62 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.669 0.271 . . . . 0.0 110.523 179.394 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.73 -45.43 94.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.264 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -61.67 -38.62 88.43 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.444 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -71.4 -44.29 65.19 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.678 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.0 t -60.67 -50.26 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -179.344 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -83.82 -24.78 30.82 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.53 24.81 32.25 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.913 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.619 ' O ' HD12 ' A' ' 40' ' ' LEU . 14.1 pt20 -177.43 147.58 0.67 Allowed Pre-proline 0 N--CA 1.465 0.296 0 CA-C-N 116.638 0.219 . . . . 0.0 110.611 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.83 108.4 2.56 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.397 2.065 . . . . 0.0 112.0 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.68 HD22 ' CD1' ' A' ' 79' ' ' LEU . 5.1 mp -89.79 140.8 29.24 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.088 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -75.83 120.34 21.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.013 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.508 HD23 ' HB3' ' A' ' 79' ' ' LEU . 67.6 mt -86.71 122.9 31.25 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.449 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -112.89 124.4 52.53 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.111 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.441 ' CD2' HD11 ' A' ' 75' ' ' LEU . 11.7 t80 -108.51 129.01 55.3 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.554 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 6.1 mtt -117.44 127.02 53.61 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.726 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -86.56 -51.93 5.86 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.719 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -173.54 -63.12 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.422 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.61 -27.52 11.3 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.489 179.707 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.13 153.2 26.06 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.901 0.381 . . . . 0.0 111.31 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.4 t -117.22 128.69 55.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.768 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.8 mm -113.85 133.44 59.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.611 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.473 HD23 ' N ' ' A' ' 53' ' ' LEU . 6.8 tt -95.79 130.06 42.83 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.172 -179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.473 ' N ' HD23 ' A' ' 52' ' ' LEU . 1.2 mt -81.95 107.88 15.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.987 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -38.65 4.67 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.408 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -131.67 -179.39 5.35 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.091 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -64.63 -30.19 71.2 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.816 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -57.91 -39.32 77.65 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.583 0.23 . . . . 0.0 110.928 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -68.46 -43.28 77.34 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.832 0.348 . . . . 0.0 110.488 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.56 -44.78 95.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.933 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.23 -41.46 98.43 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.7 mtpm? -66.15 -36.74 83.92 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.217 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.9 -41.48 99.44 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.599 0.238 . . . . 0.0 111.522 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 11.8 mt -66.12 -43.25 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.587 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.9 -42.7 76.41 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.177 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 14.7 mt -66.43 -42.16 89.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.042 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.625 HD22 HD23 ' A' ' 75' ' ' LEU . 15.8 tp -59.78 -44.58 93.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.887 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.54 -35.96 70.99 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.902 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.2 ttt-85 -70.61 -35.12 72.82 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.298 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.5 t -86.49 94.19 9.36 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.718 0.294 . . . . 0.0 111.048 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 91.2 p -58.79 -36.98 75.33 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.145 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.2 p -60.35 -33.68 72.76 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.389 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.0 mtt -85.88 123.7 31.53 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.187 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.91 -33.95 7.78 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.233 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -116.65 156.46 27.02 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.583 0.23 . . . . 0.0 110.962 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.625 HD23 HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -91.88 129.35 37.87 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.662 179.817 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.404 ' N ' HD13 ' A' ' 75' ' ' LEU . 0.0 OUTLIER -97.17 107.82 20.42 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.048 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.574 ' CG1' HD12 ' A' ' 75' ' ' LEU . 2.9 mp -128.08 132.16 68.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.956 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.7 tp -102.51 118.29 36.54 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.912 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.68 ' CD1' HD22 ' A' ' 40' ' ' LEU . 2.7 pp -110.96 135.41 51.52 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.949 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.447 ' C ' HD23 ' A' ' 40' ' ' LEU . 1.1 mp -137.54 148.05 45.64 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.162 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 m . . . . . 0 C--O 1.233 0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.696 179.713 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 . . . . . 0 N--CA 1.466 0.353 0 CA-C-O 120.867 0.365 . . . . 0.0 111.273 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.1 t -87.48 127.81 40.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.245 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -98.54 106.87 19.2 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.685 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.531 ' CG2' HD12 ' A' ' 77' ' ' ILE . 4.0 mp -109.19 133.77 53.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.307 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.82 105.13 13.86 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.546 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.747 ' HB3' HD11 ' A' ' 79' ' ' LEU . 45.6 m-85 -93.17 148.52 21.95 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.15 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -135.7 125.08 24.84 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.982 0.42 . . . . 0.0 111.153 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.2 t-160 -142.16 129.45 21.1 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.514 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.45 29.44 19.01 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.29 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 86.79 -14.1 57.17 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 120.875 -0.679 . . . . 0.0 113.304 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -91.67 132.04 36.64 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 117.078 0.439 . . . . 0.0 110.903 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -101.9 147.7 26.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.184 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -137.1 141.28 42.33 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.969 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.8 mt -111.72 120.76 62.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.125 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.5 mt -133.3 132.74 58.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.141 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.31 141.65 33.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.164 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -123.77 134.94 53.57 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.342 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.6 m -87.47 134.85 33.54 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.142 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.51 149.23 74.81 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.968 179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.22 121.99 8.28 Favored 'Cis proline' 0 C--N 1.35 0.651 0 C-N-CA 123.312 -1.537 . . . . 0.0 112.5 -0.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.421 ' O ' HG13 ' A' ' 23' ' ' VAL . 14.0 p -83.04 119.63 32.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.785 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.434 ' O ' HG23 ' A' ' 28' ' ' VAL . 7.0 mmmt -98.74 143.79 28.7 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.946 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -54.63 -41.41 69.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.001 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.84 -44.48 96.9 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.76 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -62.63 -44.2 96.88 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.259 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 24' ' ' LYS . 22.5 t -67.25 -48.4 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.105 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.04 -39.05 77.45 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.811 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -58.92 -45.8 89.49 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.836 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.678 ' O ' HG23 ' A' ' 35' ' ' VAL . 3.7 mmtt -61.11 -47.88 84.26 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.946 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.2 t -59.0 -46.83 91.42 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.725 0.298 . . . . 0.0 110.849 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.513 HG23 ' N ' ' A' ' 39' ' ' PRO . 22.5 m -61.54 -40.16 93.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.287 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 58.9 m -71.73 -46.22 59.28 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.678 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.1 t -62.79 -50.1 81.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 121.224 -0.19 . . . . 0.0 111.495 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.545 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 85.6 m-85 -83.86 -19.39 34.94 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.306 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.88 -20.42 49.95 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.958 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.501 ' O ' HD12 ' A' ' 40' ' ' LEU . 18.0 mt-30 -134.81 147.36 62.65 Favored Pre-proline 0 N--CA 1.462 0.141 0 CA-C-N 116.816 0.308 . . . . 0.0 110.387 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.513 ' N ' HG23 ' A' ' 33' ' ' THR . 57.6 Cg_endo -72.79 99.25 1.05 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.395 2.063 . . . . 0.0 112.269 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.501 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.2 mp -87.82 156.8 19.22 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.026 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -91.12 140.28 29.97 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.975 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.64 107.47 19.23 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.99 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 113.9 27.7 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.994 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.414 ' CD2' HG12 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -91.68 129.15 37.7 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.219 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -125.35 118.23 25.46 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.951 0.405 . . . . 0.0 110.707 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -88.86 -71.47 0.59 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.049 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -136.19 -72.11 0.45 Allowed 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.37 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -120.9 19.44 11.72 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.127 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.72 147.46 52.51 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.766 0.317 . . . . 0.0 111.134 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.0 p -119.17 126.66 52.09 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.58 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mp -113.62 131.53 65.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.626 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -107.29 121.36 44.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.255 -179.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.6 mt -77.3 95.53 4.38 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.565 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.08 -34.85 11.57 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.134 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -138.24 173.18 11.89 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.847 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -59.26 -34.71 72.57 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.219 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -53.88 -41.14 67.22 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.916 0.389 . . . . 0.0 110.736 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -39.77 94.87 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.011 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 tp -65.35 -43.27 91.39 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.886 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.85 -41.55 97.97 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.797 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -65.21 -36.73 85.1 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.957 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.47 -39.17 92.55 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.499 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 25.4 mt -64.23 -43.18 97.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.751 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.43 -39.27 70.05 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.187 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.8 mt -67.32 -44.62 87.16 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.133 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.572 HD13 ' HG ' ' A' ' 75' ' ' LEU . 1.0 OUTLIER -59.63 -47.24 86.38 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.537 -0.302 . . . . 0.0 110.683 179.933 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -64.26 -37.39 87.31 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.7 -33.03 74.95 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.2 179.637 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.1 t -67.02 136.24 54.97 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.83 0.348 . . . . 0.0 111.252 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 18.2 m -74.77 -25.75 59.28 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.501 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.1 t -134.4 82.35 1.96 Allowed 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.06 0.457 . . . . 0.0 110.578 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 30.7 tpp -158.25 105.44 1.91 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.596 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -102.82 -63.15 1.19 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.028 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.8 t -82.0 158.17 23.94 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.181 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.572 ' HG ' HD13 ' A' ' 66' ' ' LEU . 7.2 mp -101.15 125.22 47.76 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.102 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 107.38 19.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.662 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.531 HD12 ' CG2' ' A' ' 6' ' ' ILE . 22.1 mt -129.44 131.77 67.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.829 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.82 132.32 47.65 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.636 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.747 HD11 ' HB3' ' A' ' 8' ' ' PHE . 10.0 mt -93.66 128.81 40.02 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.174 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.9 mt -133.96 136.24 44.04 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.463 0.184 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.767 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 . . . . . 0 N--CA 1.468 0.461 0 CA-C-O 120.789 0.328 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.8 t -97.78 135.96 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.328 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.0 114.37 23.55 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.113 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.53 ' CG2' HD12 ' A' ' 77' ' ' ILE . 31.0 mm -109.06 119.75 59.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.901 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.41 114.46 26.23 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.746 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PHE . . . . . 0.473 ' CD2' HD12 ' A' ' 17' ' ' ILE . 51.8 m-85 -100.37 140.32 34.79 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.184 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.72 124.74 20.03 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.124 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -138.89 112.04 7.99 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.575 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 58.46 36.3 25.24 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.353 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.69 -14.27 61.98 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.886 -0.674 . . . . 0.0 113.096 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.8 104.55 11.39 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.957 0.379 . . . . 0.0 110.622 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptp85 -92.3 136.85 32.86 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.189 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.434 ' HD3' HD11 ' A' ' 17' ' ' ILE . 16.0 ttt85 -137.06 143.53 42.68 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.162 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.93 120.71 61.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.864 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.473 HD12 ' CD2' ' A' ' 8' ' ' PHE . 27.8 mt -134.72 132.55 54.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.168 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.59 143.83 25.94 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.128 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.506 ' CE2' HG22 ' A' ' 28' ' ' VAL . 6.9 m-85 -129.99 121.14 25.94 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.282 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -76.11 129.41 36.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.838 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -70.25 150.73 95.94 Favored Pre-proline 0 N--CA 1.463 0.212 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.086 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -75.24 134.13 34.52 Favored 'Cis proline' 0 C--N 1.35 0.651 0 C-N-CA 123.705 -1.373 . . . . 0.0 112.472 0.116 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.419 ' O ' HG13 ' A' ' 23' ' ' VAL . 11.6 p -84.12 118.32 31.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-O 120.944 0.402 . . . . 0.0 110.792 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 28' ' ' VAL . 20.3 mmtm -101.1 129.94 47.07 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.862 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.631 ' CE1' HD12 ' A' ' 42' ' ' LEU . 54.0 t80 -55.55 -45.16 77.28 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.952 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -60.1 -42.32 94.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.053 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.49 -44.07 97.27 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.036 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.562 ' O ' HG23 ' A' ' 32' ' ' VAL . 23.3 t -66.75 -48.0 81.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.577 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.8 -41.59 87.12 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.207 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -57.31 -45.36 84.28 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.877 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.74 ' O ' HG23 ' A' ' 35' ' ' VAL . 3.4 tttm -66.54 -47.83 71.65 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.691 -0.232 . . . . 0.0 110.989 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 28' ' ' VAL . 45.8 t -58.34 -43.67 86.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.711 0.291 . . . . 0.0 110.982 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 97.2 m -62.84 -38.92 92.7 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.905 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.6 m -71.68 -45.61 61.39 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.384 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.74 HG23 ' O ' ' A' ' 31' ' ' LYS . 40.9 t -58.88 -49.69 82.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 120.524 0.202 . . . . 0.0 111.509 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -83.4 -26.91 29.99 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.691 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.76 25.54 32.1 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.954 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.556 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -169.97 145.67 2.48 Favored Pre-proline 0 N--CA 1.464 0.265 0 CA-C-N 116.871 0.335 . . . . 0.0 110.96 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.52 103.52 1.56 Allowed 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.586 2.191 . . . . 0.0 112.394 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.556 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.9 mp -96.26 154.92 16.99 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.107 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -88.72 140.97 28.9 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.997 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.631 HD12 ' CE1' ' A' ' 25' ' ' TYR . 67.5 mt -100.71 124.05 45.78 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.606 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.486 ' ND1' HD21 ' A' ' 80' ' ' LEU . 6.3 m80 -117.0 129.32 55.95 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.162 -179.521 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.404 ' CD2' ' HB1' ' A' ' 62' ' ' ALA . 19.2 t80 -114.32 129.69 56.65 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.763 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.4 mtm -111.31 113.36 25.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.542 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.9 p-10 -67.17 -52.59 39.46 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.282 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -148.84 -73.9 0.18 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.331 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -119.67 14.13 12.58 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.336 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.48 148.72 52.66 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.66 0.267 . . . . 0.0 111.164 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.4 m -112.21 128.76 56.34 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.112 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.7 mp -115.96 132.1 66.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.925 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -81.88 134.31 35.39 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.706 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp -102.65 104.03 14.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.059 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.43 -35.92 6.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.358 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -120.17 170.83 8.95 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.771 0.319 . . . . 0.0 111.051 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.48 -35.51 77.87 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.03 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -55.07 -41.16 71.16 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.069 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -64.03 -47.25 80.97 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.68 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.487 HD13 ' HD1' ' A' ' 25' ' ' TYR . 5.0 tp -63.17 -41.88 99.3 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.149 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -43.07 99.81 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.01 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -34.07 77.23 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.132 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.404 ' HB1' ' CD2' ' A' ' 44' ' ' TYR . . . -62.57 -35.34 79.19 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.275 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.598 ' CD1' HD11 ' A' ' 75' ' ' LEU . 29.8 mm -64.24 -44.56 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.627 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -40.88 71.82 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.118 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 37.1 mm -63.34 -45.14 98.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.912 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 tp -62.8 -44.66 95.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.719 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -64.32 -34.7 78.75 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.274 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -32.13 71.73 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.054 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -70.9 154.15 42.07 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.047 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.3 p -76.22 -33.66 59.23 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.362 179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.7 p -70.66 -76.01 0.11 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.525 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.2 ttt 53.33 82.8 0.07 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.849 0.357 . . . . 0.0 111.217 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.85 -39.69 3.24 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.94 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.3 t -155.76 162.67 40.47 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.533 0.206 . . . . 0.0 110.946 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.598 HD11 ' CD1' ' A' ' 63' ' ' ILE . 0.3 OUTLIER -94.43 128.22 40.84 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.088 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.84 109.6 20.93 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.97 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.53 HD12 ' CG2' ' A' ' 6' ' ' ILE . 32.7 mt -128.79 128.64 67.84 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.925 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.99 131.3 48.49 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.741 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.425 HD23 ' CD2' ' A' ' 42' ' ' LEU . 2.3 mt -100.56 133.05 45.58 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.039 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.486 HD21 ' ND1' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -156.57 135.71 12.01 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.83 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.464 0.271 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.88 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.1 p -149.82 78.09 1.34 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.871 0.367 . . . . 0.0 111.044 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -169.83 80.34 0.11 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.073 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.0 t -82.07 134.81 26.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.799 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.2 ttm105 -97.97 113.01 24.73 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.531 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.534 HG23 ' HB2' ' A' ' 75' ' ' LEU . 4.0 mp -114.61 134.09 58.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.185 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -104.33 114.66 29.04 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.878 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.689 ' CD2' HD12 ' A' ' 17' ' ' ILE . 79.4 m-85 -102.52 143.45 32.2 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.153 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.422 ' HG3' ' HG3' ' A' ' 14' ' ' ARG . 36.7 tt0 -133.01 129.51 38.25 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.344 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -139.24 115.1 10.12 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.518 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.02 34.28 23.44 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.234 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.44 -14.24 61.71 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 120.995 -0.622 . . . . 0.0 113.253 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -85.06 119.43 25.44 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.996 0.398 . . . . 0.0 110.641 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.422 ' HG3' ' HG3' ' A' ' 9' ' ' GLU . 2.7 mpt_? -100.05 149.01 23.92 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.195 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.4 mtp-105 -144.41 143.73 31.06 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.32 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mt -103.01 118.85 50.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.842 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.689 HD12 ' CD2' ' A' ' 8' ' ' PHE . 34.1 mt -128.97 135.92 60.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-O 120.77 0.319 . . . . 0.0 111.24 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.15 140.92 37.59 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.337 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.552 ' CE2' HG13 ' A' ' 28' ' ' VAL . 8.5 m-85 -128.3 119.77 25.75 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.026 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.2 t -73.61 125.77 28.78 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.017 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -63.15 148.21 93.31 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.237 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.19 134.01 33.4 Favored 'Cis proline' 0 C--N 1.35 0.612 0 C-N-CA 123.33 -1.529 . . . . 0.0 112.61 0.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 23' ' ' VAL . 11.6 p -79.58 114.28 20.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 121.014 0.435 . . . . 0.0 110.948 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.477 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.6 OUTLIER -102.53 140.64 36.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.197 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -59.15 -38.47 79.76 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.929 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.44 -45.06 95.03 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.637 0.256 . . . . 0.0 111.099 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.29 -42.33 88.53 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.179 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.587 ' O ' HG23 ' A' ' 32' ' ' VAL . 40.8 t -70.33 -48.99 57.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.07 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.75 -44.53 96.72 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.444 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -58.52 -39.0 78.92 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.559 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.744 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -67.05 -47.61 70.81 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.761 179.537 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 28' ' ' VAL . 26.3 t -62.51 -44.34 99.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.149 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.8 m -62.43 -39.1 92.22 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.23 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.0 m -71.68 -45.08 63.02 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 121.253 -0.179 . . . . 0.0 111.467 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.744 HG23 ' O ' ' A' ' 31' ' ' LYS . 50.8 t -60.14 -50.19 81.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.492 0.187 . . . . 0.0 111.373 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.461 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 25.0 m-85 -82.33 -25.24 34.07 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.05 22.05 69.44 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.996 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -152.63 152.0 27.92 Favored Pre-proline 0 N--CA 1.463 0.217 0 CA-C-N 116.949 0.374 . . . . 0.0 110.997 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.425 ' HG2' ' HB3' ' A' ' 83' ' ' ASP . 60.7 Cg_endo -72.64 85.0 1.16 Allowed 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.599 2.2 . . . . 0.0 112.131 179.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.7 mp -85.83 145.09 27.36 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.225 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -97.78 139.73 33.22 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.952 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.8 mt -98.54 127.83 44.63 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.981 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -115.31 116.29 28.05 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.082 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -91.87 108.15 19.72 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.894 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -104.99 117.5 34.16 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.476 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -76.32 -59.97 2.54 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.785 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -178.38 -51.04 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.265 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -103.58 -31.98 9.66 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.522 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.5 tp -119.8 156.4 30.7 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.805 0.336 . . . . 0.0 111.637 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.9 t -116.74 131.28 56.99 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.136 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.9 mm -114.29 133.84 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.977 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.517 HD22 ' HG2' ' A' ' 54' ' ' LYS . 5.7 tt -96.55 135.19 38.79 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.768 0.318 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.459 HD23 ' HB2' ' A' ' 58' ' ' ASP . 3.0 mt -87.83 102.1 14.36 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.176 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.517 ' HG2' HD22 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -106.35 -35.17 7.22 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.349 179.74 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 22.9 p30 -142.8 -179.94 6.63 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.314 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -61.2 -33.62 73.76 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.814 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -53.06 -42.82 66.17 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.951 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.459 ' HB2' HD23 ' A' ' 53' ' ' LEU . 61.7 m-20 -65.28 -44.59 87.54 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.903 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.508 ' HG ' HD11 ' A' ' 63' ' ' ILE . 12.7 tp -67.81 -40.15 83.87 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.09 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.21 -43.25 99.18 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.781 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -64.48 -44.0 92.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.416 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.23 -45.67 92.31 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.864 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.508 HD11 ' HG ' ' A' ' 59' ' ' LEU . 15.0 mt -66.47 -42.16 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 120.556 0.217 . . . . 0.0 110.925 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -56.76 -45.63 81.95 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.244 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 15.9 mt -70.28 -41.24 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.235 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.25 -46.85 88.67 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.952 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.3 -38.43 89.35 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.733 0.302 . . . . 0.0 110.83 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 mmm180 -62.43 -33.75 75.42 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.281 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.9 t -87.69 103.12 15.3 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.978 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 85.5 p -61.78 -31.95 72.19 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.288 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.7 m -60.32 -42.74 96.24 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.924 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mtt -68.61 151.41 46.77 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.119 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -135.83 -64.74 0.61 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.212 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.36 173.0 8.99 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.023 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.534 ' HB2' HG23 ' A' ' 6' ' ' ILE . 6.9 mp -112.97 125.82 54.81 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.103 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 mtt-85 -92.57 107.49 19.25 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.711 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.4 mt -129.59 132.25 66.37 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.868 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.3 tp -102.08 127.38 49.0 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.71 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 8' ' ' PHE . 1.6 mt -93.67 127.71 39.5 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.099 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mp -132.5 142.97 49.44 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.867 0.365 . . . . 0.0 111.375 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 p -85.47 87.85 7.44 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.968 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -118.95 76.0 1.07 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.359 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.425 ' HB3' ' HG2' ' A' ' 39' ' ' PRO . 6.5 p-10 -92.18 96.22 10.18 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.416 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 67.91 107.1 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.522 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -95.54 84.81 4.04 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.974 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 64.26 170.5 0.18 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.663 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -97.5 86.93 3.97 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.921 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.53 -178.26 3.89 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.918 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -122.13 123.86 42.54 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.916 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -112.66 100.47 8.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.903 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -129.62 132.01 46.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.008 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.8 112.03 9.75 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.848 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 28.5 t60 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.36 -0.828 . . . . 0.0 111.106 179.969 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 120.666 0.269 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 20' ' ' SER . 1.6 m -118.8 154.53 32.69 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.258 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -165.08 94.64 0.66 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.818 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.513 HG23 ' HG3' ' A' ' 21' ' ' ARG . 39.5 t -71.82 131.05 35.11 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.107 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.451 ' NE ' HG21 ' A' ' 16' ' ' ILE . 5.7 ttt180 -86.65 110.45 19.86 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.96 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 21.7 mt -113.56 129.46 69.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.95 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -100.85 123.26 44.78 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.812 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.602 ' CD2' HD12 ' A' ' 17' ' ' ILE . 99.1 m-85 -115.54 133.46 56.02 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.009 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -134.1 127.63 32.52 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.909 0.385 . . . . 0.0 111.326 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -148.43 131.19 16.02 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.59 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 60.51 29.54 19.09 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.266 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.29 -13.86 59.0 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.857 -0.687 . . . . 0.0 113.288 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -83.22 107.74 15.97 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 117.056 0.428 . . . . 0.0 110.942 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.0 ptt180 -97.27 135.99 38.4 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.108 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 -149.75 155.47 40.2 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.3 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.451 HG21 ' NE ' ' A' ' 5' ' ' ARG . 4.3 mt -117.83 120.09 63.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.848 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.602 HD12 ' CD2' ' A' ' 8' ' ' PHE . 22.9 mt -117.39 132.14 68.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.252 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.67 137.07 38.65 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.092 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -128.85 125.88 38.62 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.044 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 2' ' ' SER . 78.3 p -67.75 139.37 56.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.177 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.513 ' HG3' HG23 ' A' ' 4' ' ' VAL . 11.4 mtm180 -88.9 149.67 43.99 Favored Pre-proline 0 C--O 1.234 0.241 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.144 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -74.63 122.34 8.0 Favored 'Cis proline' 0 C--N 1.351 0.669 0 C-N-CA 123.64 -1.4 . . . . 0.0 112.498 0.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.41 ' N ' ' HA ' ' A' ' 21' ' ' ARG . 12.3 p -70.59 125.36 28.72 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.755 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 28' ' ' VAL . 3.9 mttp -95.88 130.37 42.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -56.17 -38.41 70.88 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.741 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.86 -44.36 94.18 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.826 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.46 -41.62 88.77 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.252 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 24' ' ' LYS . 39.3 t -68.03 -48.99 72.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.971 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.26 -43.08 92.47 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.848 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 -42.18 80.73 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.911 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.74 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -63.43 -48.1 79.19 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.222 179.601 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.0 t -62.6 -42.47 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.287 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.5 m -63.93 -39.06 93.3 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.044 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 35.0 m -71.51 -47.15 57.15 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.74 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.3 t -58.54 -49.46 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 120.52 0.2 . . . . 0.0 111.506 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.476 ' CE2' HD13 ' A' ' 79' ' ' LEU . 25.4 m-85 -83.6 -24.66 31.38 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.85 26.29 67.35 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.98 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -157.78 155.94 27.62 Favored Pre-proline 0 C--O 1.233 0.189 0 CA-C-N 116.864 0.332 . . . . 0.0 111.173 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.94 95.65 0.91 Allowed 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.657 2.238 . . . . 0.0 112.165 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mp -100.32 148.6 24.5 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.068 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -100.47 139.78 35.66 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.996 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.452 HD22 HG21 ' A' ' 77' ' ' ILE . 35.6 mt -87.68 106.3 17.95 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.662 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -100.53 114.93 28.96 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.017 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.471 ' CZ ' ' HB1' ' A' ' 62' ' ' ALA . 1.1 t80 -93.46 126.9 38.85 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.168 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -128.26 116.83 20.46 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.812 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -77.5 -49.18 15.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.436 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -172.83 -62.93 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.476 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.65 -23.64 11.35 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.771 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.35 141.07 36.57 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.839 0.352 . . . . 0.0 111.581 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.59 128.16 55.54 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.964 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.2 mt -122.16 133.08 69.57 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.758 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.5 tt -95.07 135.32 36.75 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 mt -97.15 108.79 21.59 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.94 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -107.84 -40.94 5.12 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.221 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.1 p-10 -129.93 179.65 5.74 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.474 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -61.63 -30.92 71.02 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.185 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.25 -46.72 72.66 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.057 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -68.61 -37.52 79.83 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.847 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 tp -66.9 -43.7 82.72 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.805 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -66.53 -37.42 84.98 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.154 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -37.01 84.39 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.762 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.471 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -65.37 -43.64 90.15 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.081 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.635 HD13 HD21 ' A' ' 75' ' ' LEU . 39.4 mm -64.12 -43.25 97.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.143 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -53.82 -46.02 71.0 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.859 0.361 . . . . 0.0 110.848 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.6 mt -64.53 -39.43 85.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.966 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tp -65.23 -46.73 79.43 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.188 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.42 ' OD2' HG22 ' A' ' 63' ' ' ILE . 10.9 m-20 -61.27 -36.61 80.49 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.686 0.279 . . . . 0.0 111.061 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.9 mtt-85 -60.39 -33.53 72.61 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.421 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.6 p -80.32 132.97 35.89 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.728 0.299 . . . . 0.0 111.168 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.2 p -76.21 -33.87 59.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.681 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.2 p -97.31 38.13 1.28 Allowed 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.82 142.78 44.6 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.808 0.337 . . . . 0.0 111.508 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.96 73.37 1.48 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.848 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.7 t 60.64 -169.05 0.16 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.488 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.635 HD21 HD13 ' A' ' 63' ' ' ILE . 2.2 mp -111.01 133.4 53.43 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.024 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.4 mtt85 -101.61 107.49 18.76 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.835 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.452 HG21 HD22 ' A' ' 42' ' ' LEU . 29.9 mt -129.47 132.13 66.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.499 HD23 HD11 ' A' ' 80' ' ' LEU . 0.9 OUTLIER -101.98 120.58 40.64 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.668 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 8' ' ' PHE . 1.8 mt -95.76 124.85 39.97 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.95 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.499 HD11 HD23 ' A' ' 78' ' ' LEU . 11.3 mt -137.41 147.71 45.63 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.006 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.2 m -76.81 122.97 25.54 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.074 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -121.17 36.5 4.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.381 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -159.22 79.67 0.75 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.934 0.397 . . . . 0.0 110.843 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.07 74.86 4.08 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.421 -179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -141.88 -177.16 5.07 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.105 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.69 157.18 37.76 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.837 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -90.69 -40.07 12.08 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.191 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.9 m170 -137.74 143.79 41.35 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.748 0.309 . . . . 0.0 111.162 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -147.08 140.3 25.35 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.996 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 63.75 90.9 0.08 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.121 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -92.74 131.61 37.66 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.126 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -76.97 154.77 33.22 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.077 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.057 -0.973 . . . . 0.0 111.384 179.964 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 120.476 0.179 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.1 p -162.41 91.5 0.77 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.0 0.429 . . . . 0.0 111.099 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -163.92 96.31 0.81 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.466 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 24.2 t -70.23 126.55 30.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.608 0.242 . . . . 0.0 110.604 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -86.89 112.75 22.07 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.047 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.435 HD12 ' HD2' ' A' ' 19' ' ' PHE . 4.9 mt -113.23 136.02 50.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.901 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -97.63 127.79 43.85 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.829 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -108.89 134.74 51.16 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.997 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.24 125.87 50.16 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.263 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -149.2 123.4 9.53 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.556 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 57.99 35.52 25.33 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 120.93 0.395 . . . . 0.0 110.878 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.19 12.76 76.29 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.126 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -100.98 145.77 28.26 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.934 0.367 . . . . 0.0 110.96 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -97.79 142.74 29.18 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.217 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.403 ' NH2' HG11 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -144.29 136.91 26.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.188 179.858 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.4 mm -115.16 112.38 39.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.865 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 24.3 mm -129.56 125.98 62.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.928 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.74 146.47 26.5 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.307 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.435 ' HD2' HD12 ' A' ' 6' ' ' ILE . 46.5 m-85 -131.26 120.95 23.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.836 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.4 p -68.08 145.41 54.45 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.968 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 mtt85 -87.55 143.17 33.59 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.086 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -77.52 144.32 76.89 Favored 'Cis proline' 0 C--N 1.349 0.602 0 C-N-CA 123.337 -1.526 . . . . 0.0 112.81 0.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.1 p -99.24 130.44 48.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.989 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.461 ' O ' HG23 ' A' ' 28' ' ' VAL . 7.4 mmtt -102.27 133.19 47.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.805 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.43 ' HE1' HD12 ' A' ' 42' ' ' LEU . 75.8 t80 -57.88 -38.51 75.89 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.927 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.81 -44.11 97.29 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.994 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.94 -44.29 96.48 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.125 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.773 ' O ' HG23 ' A' ' 32' ' ' VAL . 23.9 t -61.29 -48.14 90.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.788 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.19 -43.97 89.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.229 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -57.73 -47.05 83.54 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.988 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.637 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -61.05 -44.7 96.99 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.861 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 28' ' ' VAL . 38.5 t -61.24 -42.7 94.48 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.914 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.4 m -61.66 -39.5 91.61 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.969 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.6 m -71.58 -47.96 51.4 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.755 -0.202 . . . . 0.0 111.373 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 31' ' ' LYS . 42.7 t -61.84 -50.16 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-O 120.62 0.248 . . . . 0.0 111.245 -179.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -78.25 -24.13 47.02 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.649 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.61 19.17 74.13 Favored Glycine 0 CA--C 1.525 0.662 0 C-N-CA 121.07 -0.585 . . . . 0.0 113.166 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -168.4 154.31 6.76 Favored Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 116.867 0.334 . . . . 0.0 110.74 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.78 143.62 46.43 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.584 2.189 . . . . 0.0 112.387 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.658 HD13 HG12 ' A' ' 32' ' ' VAL . 1.1 mp -138.07 163.34 31.85 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.072 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.6 125.88 51.16 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.446 HD23 ' HB3' ' A' ' 79' ' ' LEU . 75.2 mt -84.29 113.33 21.05 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.035 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 121.65 44.62 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.193 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.476 ' CE2' ' HB1' ' A' ' 62' ' ' ALA . 21.0 t80 -108.31 116.67 32.39 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.365 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.3 mtt -104.3 133.67 48.81 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.984 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -90.8 -51.13 5.52 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.742 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -171.41 -62.47 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.531 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -107.98 -29.15 9.17 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.43 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.21 160.22 16.0 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.914 0.388 . . . . 0.0 111.32 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.44 132.38 56.24 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.901 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.8 mt -113.65 134.38 56.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.83 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.08 126.73 35.26 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.182 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 44' ' ' TYR . 5.7 mt -88.16 86.48 7.1 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.648 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -106.0 -33.0 8.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.292 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -117.11 158.61 23.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.726 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -59.9 -35.01 73.95 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.711 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.14 -39.96 70.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.117 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -60.75 -45.51 94.03 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.91 0.386 . . . . 0.0 110.793 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 tp -71.04 -38.31 72.54 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.001 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.61 -43.15 90.5 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.108 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -34.37 77.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.954 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.476 ' HB1' ' CE2' ' A' ' 44' ' ' TYR . . . -62.36 -39.77 94.23 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.299 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.4 mm -66.48 -42.88 90.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.595 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -59.03 -45.36 90.93 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.984 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.5 mt -65.75 -44.44 93.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.026 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.5 tp -63.67 -37.96 89.3 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.173 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -57.47 -38.15 74.05 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.995 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.98 -31.56 69.33 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.036 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.9 t -66.69 138.24 57.27 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.802 0.334 . . . . 0.0 111.355 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.9 m -75.55 -35.15 60.73 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.43 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 53.2 p -96.39 37.41 1.26 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.45 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.94 105.45 0.57 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.776 0.322 . . . . 0.0 110.775 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.46 86.9 2.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.588 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 p 55.33 -173.8 0.05 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.416 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 75' ' ' LEU . 3.7 mm? -112.75 130.22 56.14 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -92.99 107.76 19.47 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.916 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.5 mt -129.54 131.18 67.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.763 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.76 118.8 37.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.42 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.446 ' HB3' HD23 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -119.95 129.58 54.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.006 -179.723 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.72 147.39 32.93 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.644 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.56 82.06 0.17 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.05 0.452 . . . . 0.0 110.808 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.43 44.31 0.7 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.472 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -73.36 90.2 1.65 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.5 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.8 mtt180 -148.91 -81.06 0.12 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.111 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -179.3 166.39 1.48 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.78 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 mt 61.75 -176.52 0.13 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.326 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -106.89 178.29 4.6 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -35.43 63.78 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.354 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.2 m170 69.02 158.27 0.16 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.326 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 57.13 74.94 0.39 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.429 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 5.2 p-80 -153.93 -46.52 0.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.396 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 31.4 m80 -127.14 36.67 4.39 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.75 0.309 . . . . 0.0 111.086 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 26.3 t60 . . . . . 0 C--O 1.252 1.2 0 CA-C-O 118.715 -0.66 . . . . 0.0 111.681 179.734 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.673 0.273 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 4.0 m -133.62 -174.42 3.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.856 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' A' ' 2' ' ' SER . 7.6 m-20 67.2 109.81 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.216 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.6 t -107.37 117.74 53.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.996 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.23 105.15 17.02 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.501 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.5 mt -100.5 116.89 44.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.245 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -109.03 113.73 26.85 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.643 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.63 ' HB2' HD11 ' A' ' 79' ' ' LEU . 24.3 p90 -117.34 146.13 43.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.244 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -128.34 144.46 51.13 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.354 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -143.37 113.05 6.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.491 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 m120 57.6 39.28 27.73 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.233 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.56 -14.09 60.68 Favored Glycine 0 CA--C 1.524 0.616 0 C-N-CA 120.997 -0.62 . . . . 0.0 113.346 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -86.33 103.69 15.15 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 117.066 0.433 . . . . 0.0 110.636 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.98 140.44 29.65 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.273 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.5 mtt85 -134.72 138.59 44.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.99 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mt -117.48 123.38 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.134 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.7 mt -136.18 132.82 49.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.199 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.74 136.25 42.91 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.036 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.479 ' CE2' HG13 ' A' ' 28' ' ' VAL . 83.8 m-85 -124.84 125.56 44.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.792 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -71.5 124.93 25.75 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -73.0 146.39 87.4 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.056 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -74.79 129.19 17.89 Favored 'Cis proline' 0 C--N 1.349 0.568 0 C-N-CA 123.697 -1.376 . . . . 0.0 112.543 -0.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.2 p -96.55 130.58 44.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.249 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.428 ' O ' HG23 ' A' ' 28' ' ' VAL . 9.8 mmtm -89.56 139.84 30.14 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.029 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -59.22 -44.91 92.28 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.04 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.35 -38.86 78.06 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.954 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -65.23 -44.45 88.22 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.033 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.479 HG13 ' CE2' ' A' ' 19' ' ' PHE . 23.2 t -68.19 -49.26 68.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.871 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -59.28 -41.67 89.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.176 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -57.73 -41.68 82.32 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.983 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.754 ' O ' HG23 ' A' ' 35' ' ' VAL . 6.6 tttt -63.29 -48.07 79.65 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.42 -42.14 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.135 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.4 m -65.44 -39.05 91.61 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.228 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.6 m -71.35 -44.71 64.52 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.895 -0.139 . . . . 0.0 111.337 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.754 HG23 ' O ' ' A' ' 31' ' ' LYS . 54.3 t -60.33 -50.02 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.509 0.195 . . . . 0.0 111.214 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.62 ' CE2' HD13 ' A' ' 79' ' ' LEU . 25.7 m-85 -80.17 -26.37 39.33 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.742 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.88 26.75 55.32 Favored Glycine 0 CA--C 1.522 0.475 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.823 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.541 ' O ' HD12 ' A' ' 40' ' ' LEU . 2.5 pt20 -167.21 156.21 9.3 Favored Pre-proline 0 N--CA 1.462 0.169 0 CA-C-N 116.764 0.282 . . . . 0.0 111.0 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.38 109.39 2.83 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.575 2.183 . . . . 0.0 112.279 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.551 HD23 ' HB3' ' A' ' 79' ' ' LEU . 5.6 mp -107.84 134.84 50.2 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.926 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -84.91 133.07 34.3 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.736 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.43 ' HB3' HG21 ' A' ' 77' ' ' ILE . 2.4 mp -92.31 108.81 20.23 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.873 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -104.9 118.93 37.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.22 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.426 ' OH ' HD12 ' A' ' 75' ' ' LEU . 1.1 t80 -91.04 128.89 37.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.81 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.8 ptm -128.42 114.5 16.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.801 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -85.36 -54.15 4.77 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.546 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -167.12 -64.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.401 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -109.5 -23.71 11.36 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.748 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 tt -111.91 146.92 36.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 120.86 0.362 . . . . 0.0 111.305 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 m -120.52 132.78 55.35 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.896 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mp -116.19 133.8 61.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.658 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 tt -98.12 126.56 43.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.831 0.348 . . . . 0.0 110.86 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.8 mt -70.89 97.89 1.49 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.109 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.29 -38.13 11.67 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.182 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -152.61 -173.69 4.65 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.32 -30.79 69.74 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.267 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -53.21 -50.39 64.79 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.081 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.36 -43.5 98.68 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.986 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.51 -38.05 89.65 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.845 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.866 ' HA ' HD12 ' A' ' 63' ' ' ILE . 1.1 t0 -61.39 -43.48 98.79 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.731 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -35.53 81.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.908 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.579 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.58 -35.32 80.12 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.249 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.866 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -64.67 -42.76 95.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.748 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.16 -39.56 63.68 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.031 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.579 HD12 ' HA ' ' A' ' 62' ' ' ALA . 13.8 mt -66.32 -39.46 84.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.847 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.809 HD13 HD13 ' A' ' 75' ' ' LEU . 9.3 tp -62.71 -42.85 99.86 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.986 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -64.02 -34.4 77.91 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.336 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 50.8 ttt85 -75.43 -34.05 60.97 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.098 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.6 t -85.74 129.41 34.84 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.344 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.46 -40.49 29.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.015 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -75.36 -41.78 55.7 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.34 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.49 101.3 0.17 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.799 0.333 . . . . 0.0 111.062 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.13 -37.48 11.57 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.933 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -121.55 175.24 6.31 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.723 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.809 HD13 HD13 ' A' ' 66' ' ' LEU . 1.4 mm? -101.99 129.78 48.36 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.694 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -86.75 108.79 18.85 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.007 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.43 HG21 ' HB3' ' A' ' 42' ' ' LEU . 2.9 mt -124.81 132.08 71.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.095 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 tp -102.17 122.67 44.62 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.483 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.63 HD11 ' HB2' ' A' ' 8' ' ' PHE . 4.6 mt -96.18 135.98 37.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.085 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.04 135.89 14.54 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.984 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.3 p -58.64 107.66 0.54 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.98 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -121.86 62.77 0.93 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.93 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -98.62 50.3 0.98 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.421 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 53.12 33.61 15.48 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.402 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -145.03 158.78 43.71 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.183 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 86' ' ' LEU . 1.7 pp -150.82 128.66 11.67 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.287 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.6 75.16 0.93 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.968 0.413 . . . . 0.0 110.783 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -85.18 81.05 8.99 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.918 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -158.23 -176.73 6.07 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.941 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -80.34 149.67 30.18 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.996 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 19.5 p-80 -141.5 144.86 34.57 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.976 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 12.7 m80 -108.62 122.26 46.72 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.38 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.604 -0.712 . . . . 0.0 111.323 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 120.445 0.164 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.3 m 67.61 147.93 0.05 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.131 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 65.07 162.34 0.13 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.749 -179.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -144.81 132.7 16.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.036 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.81 111.28 20.6 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.512 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.484 HD12 ' CD1' ' A' ' 19' ' ' PHE . 27.7 mt -107.56 118.4 55.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.934 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -96.59 123.01 40.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.933 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.588 ' HB3' HD11 ' A' ' 79' ' ' LEU . 29.4 m-85 -115.73 127.15 54.91 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -122.13 132.62 54.56 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.829 0.347 . . . . 0.0 111.043 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.411 ' HB2' HD12 ' A' ' 79' ' ' LEU . 11.1 t-160 -146.04 117.2 7.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.652 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.52 33.22 22.09 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.21 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.71 -14.0 62.72 Favored Glycine 0 CA--C 1.525 0.658 0 C-N-CA 120.937 -0.649 . . . . 0.0 113.077 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -88.04 110.72 20.84 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.941 0.37 . . . . 0.0 110.887 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.66 144.3 28.9 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.201 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.1 mtt85 -133.49 149.81 51.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.993 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.523 ' N ' HD12 ' A' ' 16' ' ' ILE . 3.7 mp -115.82 112.76 41.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.803 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.527 ' N ' HD12 ' A' ' 17' ' ' ILE . 3.5 mp -123.53 136.91 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 120.861 0.362 . . . . 0.0 111.319 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.13 129.5 42.21 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.027 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.484 ' CD1' HD12 ' A' ' 6' ' ' ILE . 21.4 m-85 -124.76 126.39 45.58 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.967 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 p -66.48 135.74 54.68 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.161 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -100.54 146.31 31.81 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.042 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.21 123.49 9.42 Favored 'Cis proline' 0 C--N 1.35 0.655 0 C-N-CA 123.335 -1.527 . . . . 0.0 112.499 -0.129 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.54 130.03 36.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.975 0.417 . . . . 0.0 111.254 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.562 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -89.54 146.39 24.62 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.044 -179.859 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -56.98 -37.27 71.38 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.083 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -61.32 -43.72 98.4 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.919 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.76 -39.18 87.77 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.142 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 24' ' ' LYS . 18.7 t -67.96 -48.85 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.872 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.46 ' O ' HG22 ' A' ' 33' ' ' THR . 0.2 OUTLIER -58.7 -44.68 90.38 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.926 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.433 ' HA ' HG22 ' A' ' 33' ' ' THR . 2.0 m80 -59.99 -37.03 78.48 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.126 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.692 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -70.94 -48.06 55.59 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.857 179.642 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 28' ' ' VAL . 31.2 t -65.5 -45.75 91.81 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.431 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.46 HG22 ' O ' ' A' ' 29' ' ' GLU . 14.7 t -61.0 -38.93 87.78 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.708 -179.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.6 m -71.24 -43.78 66.62 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.2 t -64.89 -50.53 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 120.576 0.227 . . . . 0.0 111.419 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.565 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 92.1 m-85 -83.72 -13.34 54.23 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.26 24.03 71.86 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.88 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -153.15 147.31 18.75 Favored Pre-proline 0 CA--C 1.529 0.172 0 CA-C-N 116.752 0.276 . . . . 0.0 110.961 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.24 71.73 5.05 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.559 2.173 . . . . 0.0 112.124 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.4 mp -76.92 131.55 38.61 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.847 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -76.98 140.09 40.3 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.991 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.54 HD22 HG21 ' A' ' 77' ' ' ILE . 33.5 mt -82.18 118.58 23.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.897 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -116.94 119.6 35.83 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.995 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.554 ' HB2' HD11 ' A' ' 53' ' ' LEU . 0.8 OUTLIER -90.63 117.27 29.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.82 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.7 115.65 22.44 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.827 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -86.53 -72.21 0.51 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.053 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -134.9 -67.43 0.56 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.608 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -122.78 18.56 10.26 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.207 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.0 tp -131.68 138.22 48.62 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.604 0.24 . . . . 0.0 110.979 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.97 122.52 39.54 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.765 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.8 mp -114.44 131.14 67.36 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.684 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.2 tt -92.13 127.88 37.77 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.874 0.369 . . . . 0.0 111.116 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.782 ' CD2' HD12 ' A' ' 59' ' ' LEU . 5.8 mp -92.95 90.06 6.8 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.789 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.88 -31.82 15.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.145 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -132.08 174.49 10.14 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.989 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.59 -32.05 72.98 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.294 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -54.28 -42.2 69.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.71 0.29 . . . . 0.0 110.94 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.64 -46.19 83.59 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.162 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.782 HD12 ' CD2' ' A' ' 53' ' ' LEU . 2.3 tp -61.77 -41.92 98.32 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.599 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.841 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.5 t0 -61.52 -41.77 97.81 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.734 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.87 -39.49 94.33 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.835 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.435 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -62.81 -38.42 90.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.333 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.841 HD12 ' HA ' ' A' ' 60' ' ' ASP . 7.5 mt -64.37 -44.04 97.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.599 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -56.0 -42.4 76.35 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.052 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.435 HD12 ' HA ' ' A' ' 62' ' ' ALA . 17.1 mt -66.12 -45.57 90.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.112 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.454 ' CD2' HD11 ' A' ' 75' ' ' LEU . 8.4 tp -58.9 -43.47 91.04 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.803 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -69.29 -36.77 77.38 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.036 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -26.64 68.8 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.27 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.2 t -62.36 164.72 6.83 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.912 0.386 . . . . 0.0 111.382 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 p -64.06 -40.72 96.89 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.185 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.5 p -163.93 -63.92 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.232 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 63.16 -177.58 0.15 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.135 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -152.61 115.41 4.57 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.789 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.513 ' C ' HD12 ' A' ' 75' ' ' LEU . 0.4 OUTLIER 64.06 -172.2 0.17 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.954 -179.872 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.513 HD12 ' C ' ' A' ' 74' ' ' SER . 8.2 mp -125.39 125.85 44.06 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.721 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -86.2 107.07 17.73 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.914 0.387 . . . . 0.0 110.606 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.54 HG21 HD22 ' A' ' 42' ' ' LEU . 8.2 mt -127.85 131.53 69.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.723 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.47 HD13 ' HA ' ' A' ' 78' ' ' LEU . 3.6 mm? -101.93 128.95 48.11 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.538 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.588 HD11 ' HB3' ' A' ' 8' ' ' PHE . 1.4 mt -94.15 133.65 37.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.023 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.7 mt -135.37 143.78 46.25 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.146 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t -88.16 101.54 13.92 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.899 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -115.12 30.49 7.32 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.728 179.591 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -72.18 119.45 16.39 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.8 0.333 . . . . 0.0 111.022 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.6 mtm180 -136.69 -53.96 0.72 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.88 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 66.37 148.31 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.368 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 87.1 mt 68.98 146.6 0.06 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.641 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 62.45 98.98 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.404 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -134.61 -73.69 0.47 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.736 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -172.07 41.89 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.992 0.425 . . . . 0.0 110.436 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -148.34 -47.33 0.15 Allowed 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.108 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 63.66 28.63 15.06 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.67 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 70.2 137.14 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.797 0.332 . . . . 0.0 111.43 179.671 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 3.3 m80 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 117.903 -1.046 . . . . 0.0 111.016 -179.85 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.423 ' HB2' ' HB2' ' A' ' 21' ' ' ARG . 3.4 m -151.37 -174.9 4.97 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.311 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -169.53 137.29 1.78 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.214 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -138.75 141.43 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.245 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -95.01 105.5 17.42 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.916 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.455 HG23 HD12 ' A' ' 75' ' ' LEU . 2.7 mt -111.72 116.96 53.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.882 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -96.1 118.31 32.43 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.75 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.669 ' HB3' HD11 ' A' ' 79' ' ' LEU . 36.4 m-85 -96.83 129.17 44.3 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.019 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.405 ' O ' HD12 ' A' ' 79' ' ' LEU . 5.4 tt0 -119.09 128.68 54.55 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.875 0.369 . . . . 0.0 111.691 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -142.2 120.1 11.99 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.525 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 44.1 t30 54.96 38.28 30.21 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.793 0.33 . . . . 0.0 111.072 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 84.52 -14.51 46.09 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 121.168 -0.539 . . . . 0.0 113.588 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -87.32 121.02 29.22 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 117.22 0.51 . . . . 0.0 110.855 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -100.33 154.45 18.48 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.369 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.9 mtt-85 -140.04 139.97 36.07 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.913 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.9 mt -108.75 114.79 47.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.225 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.8 mt -139.88 136.06 38.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.235 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.69 133.57 41.06 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.303 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.412 ' HB2' ' CD1' ' A' ' 6' ' ' ILE . 21.5 m-85 -121.86 129.36 52.53 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.89 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.24 157.87 25.03 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.869 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.423 ' HB2' ' HB2' ' A' ' 2' ' ' SER . 2.0 mtm105 -109.51 153.98 42.56 Favored Pre-proline 0 C--O 1.234 0.253 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.113 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.421 ' HA ' ' HB3' ' A' ' 21' ' ' ARG . 72.9 Cg_endo -75.74 131.79 25.4 Favored 'Cis proline' 0 C--N 1.349 0.593 0 C-N-CA 123.189 -1.588 . . . . 0.0 112.756 0.048 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.9 p -105.6 125.73 60.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.871 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -87.04 137.46 32.33 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.727 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.484 ' CE1' HD12 ' A' ' 42' ' ' LEU . 65.5 t80 -55.68 -38.72 70.01 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.754 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.06 -43.49 95.39 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.165 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -62.63 -43.8 97.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.166 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.498 ' O ' HG23 ' A' ' 32' ' ' VAL . 39.8 t -69.09 -45.15 80.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.457 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -61.81 -38.4 87.96 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.358 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.87 -47.46 82.65 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.807 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.675 ' O ' HG23 ' A' ' 35' ' ' VAL . 11.2 mtpp -61.4 -46.59 89.52 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.894 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 28' ' ' VAL . 48.2 t -57.47 -48.17 83.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.919 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.7 m -62.33 -39.37 92.87 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.37 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.1 m -71.71 -46.26 59.23 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 31' ' ' LYS . 61.7 t -61.44 -50.16 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.514 0.197 . . . . 0.0 111.488 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -83.4 -21.46 33.01 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.41 30.35 64.75 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.812 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.569 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -168.2 151.87 5.78 Favored Pre-proline 0 N--CA 1.463 0.2 0 CA-C-N 116.59 0.195 . . . . 0.0 111.081 -179.968 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -75.17 107.38 2.47 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.573 2.182 . . . . 0.0 112.236 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.569 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.4 mp -105.44 143.16 33.99 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.298 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -88.62 129.46 35.5 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.781 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.742 HD23 HD23 ' A' ' 79' ' ' LEU . 50.7 mt -86.12 103.01 14.37 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.904 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -93.08 120.92 33.89 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.101 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.55 ' CE2' ' HB1' ' A' ' 62' ' ' ALA . 0.6 OUTLIER -96.86 125.38 41.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.994 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.2 ptp -126.65 114.23 17.76 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.035 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -86.94 -54.3 4.42 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.801 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -157.13 -65.81 0.1 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.506 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -126.2 13.23 7.74 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.533 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.6 tp -131.62 132.96 44.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.628 0.251 . . . . 0.0 110.961 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 m -110.51 126.07 53.99 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.963 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.0 mt -114.63 134.12 58.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.89 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 tt -92.08 122.3 34.45 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.81 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.427 HD21 ' HA ' ' A' ' 59' ' ' LEU . 3.1 mt -80.39 87.26 5.65 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.058 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.98 -31.75 14.78 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.382 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -142.85 -179.63 6.46 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.891 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -62.68 -31.35 72.23 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.14 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.24 -43.81 67.62 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.1 0.25 . . . . 0.0 111.099 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.25 -40.05 89.94 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.188 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.427 ' HA ' HD21 ' A' ' 53' ' ' LEU . 6.5 tp -69.3 -41.38 76.84 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.763 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -65.89 -40.21 91.34 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.341 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.8 tptt -62.67 -36.94 84.5 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.396 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.55 ' HB1' ' CE2' ' A' ' 44' ' ' TYR . . . -63.06 -38.31 90.69 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.343 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 54.0 mt -62.75 -42.52 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.005 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.25 -45.54 72.39 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.119 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 4.9 mt -69.37 -41.92 81.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.906 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.476 HD22 HD22 ' A' ' 75' ' ' LEU . 13.7 tp -61.39 -44.52 97.01 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.029 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -61.47 -39.26 90.24 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.045 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 7.8 mtm-85 -62.65 -34.3 76.79 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.243 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.0 t -87.01 119.98 27.78 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.806 0.336 . . . . 0.0 111.212 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 71.9 m -78.19 -32.47 50.08 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.253 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.6 p -93.47 35.7 1.1 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.699 0.285 . . . . 0.0 111.612 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.42 ' HE2' HD12 ' A' ' 66' ' ' LEU . 3.8 ttp -147.41 80.96 1.52 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.821 0.343 . . . . 0.0 110.816 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -103.18 31.44 4.27 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.335 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.5 m -156.52 142.52 18.03 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.65 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.879 HD12 HD11 ' A' ' 77' ' ' ILE . 0.1 OUTLIER -116.46 131.94 56.81 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 111.189 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -99.72 118.15 35.61 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.048 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.879 HD11 HD12 ' A' ' 75' ' ' LEU . 2.3 mp -125.22 132.39 71.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.759 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 mt -101.94 119.42 38.77 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.679 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.742 HD23 HD23 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -93.39 119.95 33.1 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.998 -179.805 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 pp -130.9 136.54 48.69 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.978 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 54.7 p -73.84 145.98 44.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.788 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -95.99 36.14 1.34 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.402 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -134.24 77.06 1.68 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.59 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.82 94.85 4.94 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.905 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.3 m120 60.04 65.79 1.06 Allowed 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.45 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -169.46 88.51 0.17 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.195 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -112.48 -35.48 5.54 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.458 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 66.03 26.71 10.79 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 111.809 0.299 . . . . 0.0 111.809 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 69.25 -69.42 0.16 Allowed 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 122.548 0.339 . . . . 0.0 111.492 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -98.29 -164.01 1.1 Allowed 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 68.3 88.17 0.11 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.989 0.423 . . . . 0.0 111.205 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 17.8 p80 -56.7 -38.25 72.03 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.518 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.9 t60 . . . . . 0 C--O 1.251 1.141 0 CA-C-O 118.433 -0.794 . . . . 0.0 110.898 -179.99 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.585 0.231 . . . . 0.0 111.543 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.2 m 64.25 31.42 13.05 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.011 0.434 . . . . 0.0 110.754 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.37 107.56 15.13 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.424 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.522 HG11 HD12 ' A' ' 63' ' ' ILE . 21.2 t -78.21 135.82 25.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.857 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.95 107.25 18.3 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.857 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.567 HD12 ' HD2' ' A' ' 19' ' ' PHE . 27.3 mt -110.01 120.6 61.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.977 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.09 119.2 38.4 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.669 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.905 ' HB3' HD11 ' A' ' 79' ' ' LEU . 49.7 m-85 -100.74 127.2 47.26 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.481 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.409 ' O ' HD12 ' A' ' 79' ' ' LEU . 25.8 tt0 -118.82 131.2 56.08 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.874 0.369 . . . . 0.0 111.37 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -141.74 120.62 12.75 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.513 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 m120 56.13 34.99 24.9 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.511 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.13 -14.19 61.37 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 120.915 -0.659 . . . . 0.0 113.159 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -89.43 116.93 27.98 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 117.055 0.428 . . . . 0.0 110.429 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.14 144.16 39.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.394 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.1 mtt-85 -133.98 139.41 46.06 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.9 mp -102.27 118.59 49.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.235 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -137.04 129.96 44.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.974 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.31 142.87 27.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.118 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.567 ' HD2' HD12 ' A' ' 6' ' ' ILE . 43.1 m-85 -133.84 118.08 17.57 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.941 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.5 t -64.62 130.47 43.75 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.977 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.435 ' HG3' HG23 ' A' ' 4' ' ' VAL . 4.0 mtm180 -74.46 160.02 82.18 Favored Pre-proline 0 CA--C 1.53 0.195 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.346 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.86 130.17 19.9 Favored 'Cis proline' 0 C--N 1.35 0.609 0 C-N-CA 123.219 -1.576 . . . . 0.0 112.558 -0.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -71.61 125.18 29.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.021 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.445 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -102.17 137.94 39.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.928 -179.709 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -55.91 -45.03 78.79 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.735 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -39.69 94.44 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.03 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.12 -44.41 95.71 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.105 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 24' ' ' LYS . 42.6 t -67.97 -48.42 74.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.881 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -39.24 93.48 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.111 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -58.0 -39.4 78.17 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.933 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.732 ' O ' HG23 ' A' ' 35' ' ' VAL . 4.1 tptt -69.23 -47.49 64.59 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.062 179.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.551 HG11 HD22 ' A' ' 79' ' ' LEU . 25.6 t -68.24 -43.6 84.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.477 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.7 m -60.38 -38.66 84.6 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.102 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.4 m -71.49 -43.79 65.91 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 111.464 0.172 . . . . 0.0 111.464 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.732 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.1 t -63.34 -50.86 77.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 120.535 0.207 . . . . 0.0 111.42 -179.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -83.48 -18.68 37.7 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.21 21.06 75.55 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 121.067 -0.587 . . . . 0.0 113.052 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.515 ' O ' HD12 ' A' ' 40' ' ' LEU . 34.1 mt-30 -149.71 151.64 33.23 Favored Pre-proline 0 CA--C 1.53 0.178 0 CA-C-N 116.94 0.37 . . . . 0.0 110.933 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -75.32 95.0 0.97 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.634 2.223 . . . . 0.0 112.122 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 38' ' ' GLN . 5.8 mp -93.52 145.32 24.6 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.232 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.452 ' OD2' HD11 ' A' ' 52' ' ' LEU . 4.2 t0 -91.96 130.92 37.61 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.733 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.625 HD23 HG21 ' A' ' 77' ' ' ILE . 4.3 mp -90.2 103.08 15.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.946 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.431 ' NE2' HD12 ' A' ' 52' ' ' LEU . 2.2 m80 -94.71 120.08 34.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.197 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -99.08 120.54 39.64 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.537 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.02 129.67 56.17 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.671 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -90.46 -50.67 5.82 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.735 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -171.99 -63.63 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.454 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -109.19 -26.69 9.97 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.397 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.27 138.99 40.6 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.754 0.312 . . . . 0.0 111.279 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.2 t -110.31 129.64 55.7 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.888 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.7 mt -120.01 134.09 64.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.811 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.452 HD11 ' OD2' ' A' ' 41' ' ' ASP . 3.3 tt -99.32 135.1 41.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.676 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.508 HD21 ' HA ' ' A' ' 59' ' ' LEU . 10.3 mt -73.85 86.48 1.74 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.024 0.44 . . . . 0.0 111.096 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.5 tptp -80.55 -36.63 32.76 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.234 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -152.33 178.54 9.42 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.247 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -58.3 -33.0 68.98 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.09 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.63 -43.47 72.3 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.699 0.285 . . . . 0.0 110.86 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -67.35 -40.44 85.85 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.676 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.508 ' HA ' HD21 ' A' ' 53' ' ' LEU . 9.3 tp -64.49 -44.6 90.45 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.153 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.3 -38.63 91.9 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.139 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.9 mttt -62.99 -41.93 99.7 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.494 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.82 -45.39 92.83 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.183 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.525 HD13 HD11 ' A' ' 75' ' ' LEU . 44.2 mm -65.04 -44.92 95.81 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.134 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.085 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.7 -45.54 85.56 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.379 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.9 mt -70.06 -45.16 77.27 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.969 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.567 HD21 ' O ' ' A' ' 74' ' ' SER . 9.2 tp -63.72 -46.4 85.56 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.375 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.78 -40.78 84.99 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.807 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -68.3 -33.59 74.6 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.101 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.6 t -82.31 113.91 20.43 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.923 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 m -75.25 -29.2 60.14 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.997 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.61 -35.26 65.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.184 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 mmm -108.46 154.85 21.31 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.102 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.6 mmtm -134.77 -52.14 0.8 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.709 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.567 ' O ' HD21 ' A' ' 66' ' ' LEU . 1.9 p -79.0 169.73 17.76 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.034 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.624 HD22 HD11 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -111.58 121.65 45.71 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.044 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.48 108.19 19.5 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.821 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.625 HG21 HD23 ' A' ' 42' ' ' LEU . 27.8 mt -128.94 132.2 67.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.853 HD23 HD11 ' A' ' 80' ' ' LEU . 3.5 tp -102.12 119.48 38.88 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.509 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.905 HD11 ' HB3' ' A' ' 8' ' ' PHE . 2.8 mt -93.54 131.64 38.6 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.955 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.853 HD11 HD23 ' A' ' 78' ' ' LEU . 5.0 mp -142.12 138.45 31.66 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.792 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m -65.29 134.85 54.49 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.371 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -107.65 33.88 3.83 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.202 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -155.89 99.01 1.95 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.618 -0.265 . . . . 0.0 110.886 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.45 -50.26 40.15 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.954 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.8 m120 65.68 112.57 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.891 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 tp -94.51 32.21 1.62 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.932 179.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -129.28 162.18 28.51 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.316 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER 70.12 147.7 0.07 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.18 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -135.72 -48.99 0.7 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.03 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -164.97 117.79 1.22 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.988 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -140.86 113.89 8.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.149 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 13.6 p80 -161.47 145.81 13.14 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.842 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.5 m170 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.262 179.955 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 120.85 0.357 . . . . 0.0 111.321 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.7 m -154.43 173.14 16.65 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.109 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 66.88 109.97 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.508 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.9 t -93.05 130.76 41.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.949 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -87.21 113.94 23.38 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.761 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 mm -106.69 123.98 61.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.21 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.406 ' HD3' HG13 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -108.66 111.8 23.79 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.752 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.655 ' CD2' HD11 ' A' ' 79' ' ' LEU . 11.2 p90 -116.41 149.14 39.91 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.305 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -118.01 139.85 50.6 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.086 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.682 ' HB2' HD12 ' A' ' 79' ' ' LEU . 85.6 t60 -146.03 114.54 6.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.436 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 t30 58.72 35.01 24.17 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.135 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.72 12.47 81.48 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.071 -0.585 . . . . 0.0 113.177 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -111.29 122.07 46.9 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 117.059 0.43 . . . . 0.0 110.736 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -93.32 139.72 30.34 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.147 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.439 ' HB2' ' CE2' ' A' ' 8' ' ' PHE . 16.0 mmt180 -139.04 136.7 35.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.161 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.406 HG13 ' HD3' ' A' ' 7' ' ' LYS . 2.4 mp -117.01 129.63 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.221 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 32.7 mt -140.92 129.62 24.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.131 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.6 134.61 34.27 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.031 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -129.2 121.48 27.76 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.045 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p -66.39 136.49 55.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.898 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -77.41 147.22 75.31 Favored Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.993 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.83 133.84 31.9 Favored 'Cis proline' 0 C--N 1.35 0.633 0 C-N-CA 123.347 -1.522 . . . . 0.0 112.625 0.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.7 p -81.46 123.45 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.091 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -102.66 143.76 31.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.01 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.552 ' HB2' HD13 ' A' ' 59' ' ' LEU . 62.6 t80 -60.27 -42.1 94.71 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.6 179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.418 ' HG2' ' CD2' ' A' ' 30' ' ' HIS . 12.2 tt0 -57.89 -41.6 82.88 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.098 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -62.48 -44.45 96.37 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.087 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.715 ' O ' HG23 ' A' ' 32' ' ' VAL . 37.3 t -70.99 -48.44 55.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.893 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -40.54 85.01 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.392 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' HIS . . . . . 0.418 ' CD2' ' HG2' ' A' ' 26' ' ' GLU . 4.5 m-70 -57.9 -46.67 84.59 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.697 0.284 . . . . 0.0 111.06 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.78 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -71.4 -48.26 50.92 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.094 179.986 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 28' ' ' VAL . 48.4 t -56.99 -46.29 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.374 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 91.4 m -61.2 -38.85 88.06 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.952 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.1 m -71.3 -42.27 68.88 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 111.481 0.178 . . . . 0.0 111.481 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.78 HG23 ' O ' ' A' ' 31' ' ' LYS . 41.5 t -60.2 -49.97 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-O 120.607 0.241 . . . . 0.0 111.068 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.686 ' CE2' HD13 ' A' ' 79' ' ' LEU . 69.7 m-85 -83.61 -25.79 30.55 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.883 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.35 14.0 62.7 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.03 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -154.39 152.16 25.6 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.977 0.389 . . . . 0.0 110.872 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.426 ' HG2' ' CB ' ' A' ' 83' ' ' ASP . 60.5 Cg_endo -72.46 79.74 1.78 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.641 2.227 . . . . 0.0 112.29 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.7 mp -75.31 140.03 42.85 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.878 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.0 136.81 32.79 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.02 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.536 HD22 HG21 ' A' ' 77' ' ' ILE . 10.9 mt -86.19 118.69 25.8 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.91 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.1 m170 -109.07 119.58 39.96 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.063 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -120.22 128.35 53.28 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.796 0.331 . . . . 0.0 110.672 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.5 mtm -110.49 118.52 36.47 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.377 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -60.8 -67.5 0.39 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.876 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.88 -59.79 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.37 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.456 ' O ' HD22 ' A' ' 49' ' ' LEU . 7.2 mt-10 -120.96 11.6 11.05 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.604 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.456 HD22 ' O ' ' A' ' 48' ' ' GLU . 1.4 mm? -131.22 159.2 38.47 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.689 0.281 . . . . 0.0 111.019 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.4 p -118.1 118.53 32.14 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.05 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.7 mt -113.67 133.9 58.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.858 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.3 tt -96.44 123.29 40.04 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.945 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.734 HD23 ' HB3' ' A' ' 58' ' ' ASP . 7.3 mt -92.34 81.0 4.93 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.864 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.2 tttp -103.5 -32.82 9.29 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.972 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -107.9 165.57 11.36 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.8 0.333 . . . . 0.0 111.102 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -35.85 80.72 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.952 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.47 -42.65 74.63 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.025 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.734 ' HB3' HD23 ' A' ' 53' ' ' LEU . 54.8 m-20 -60.1 -44.48 94.79 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.661 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.552 HD13 ' HB2' ' A' ' 25' ' ' TYR . 4.9 tt -66.28 -40.69 90.27 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.074 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.11 -41.45 96.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.904 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -66.32 -37.27 84.99 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.061 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.509 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.17 -45.42 91.89 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.348 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 42.3 mm -66.11 -41.04 88.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.775 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -55.33 -41.17 72.1 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.085 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.509 HD12 ' HA ' ' A' ' 62' ' ' ALA . 7.6 mt -66.81 -41.43 87.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.922 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.798 HD22 HD21 ' A' ' 75' ' ' LEU . 38.5 tp -62.76 -41.98 99.47 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.007 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -58.62 -38.01 77.13 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.209 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -31.75 64.99 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.298 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.9 t -98.9 93.09 5.84 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.219 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 89.2 p -67.88 -31.31 71.02 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.388 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.2 p -56.43 -43.67 79.65 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.182 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 6.2 ttp -83.47 157.39 22.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.223 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.4 mttm -143.73 -51.28 0.32 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.93 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.9 m -79.6 149.74 31.26 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.076 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.798 HD21 HD22 ' A' ' 66' ' ' LEU . 3.9 mm? -113.9 126.48 55.22 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.898 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.5 mtt-85 -93.02 109.91 21.37 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.944 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.536 HG21 HD22 ' A' ' 42' ' ' LEU . 38.6 mt -128.93 132.2 67.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.094 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.7 mp -102.21 132.03 48.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.673 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.686 HD13 ' CE2' ' A' ' 36' ' ' PHE . 1.7 mt -94.15 132.34 38.78 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.09 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 89.1 mt -143.63 137.31 28.21 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.905 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 p -70.51 117.69 12.37 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.131 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -138.79 37.91 2.18 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.343 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.426 ' CB ' ' HG2' ' A' ' 39' ' ' PRO . 35.6 t70 -119.35 100.0 7.04 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.756 0.312 . . . . 0.0 111.124 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.2 mtt85 -112.88 -42.05 3.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.113 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -173.84 175.57 2.83 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.603 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -88.9 55.85 3.51 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.816 0.341 . . . . 0.0 110.624 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 59.95 -171.56 0.13 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.324 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 56.2 t60 -93.38 128.06 39.27 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.907 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -164.05 178.99 7.25 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.222 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -155.8 173.96 15.99 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.064 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -68.11 140.42 56.21 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.698 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 9.5 t-80 -86.69 136.09 33.15 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.838 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 3.4 m80 . . . . . 0 C--O 1.251 1.133 0 CA-C-O 118.579 -0.724 . . . . 0.0 111.419 -179.97 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 120.563 0.22 . . . . 0.0 111.586 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.4 m 68.44 69.17 0.31 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.086 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -166.32 70.54 0.12 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.887 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -85.72 135.88 24.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.173 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -95.84 106.16 18.26 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.888 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.442 HD12 ' CD2' ' A' ' 19' ' ' PHE . 33.3 mt -101.09 126.38 54.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.018 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -98.83 116.37 30.91 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.913 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -93.38 145.63 24.34 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.247 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.32 132.76 50.2 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.348 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -146.14 113.85 6.42 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.626 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 58.3 33.74 23.42 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.12 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.96 -13.64 62.56 Favored Glycine 0 CA--C 1.526 0.719 0 C-N-CA 120.917 -0.659 . . . . 0.0 113.048 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -77.05 152.58 35.03 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 117.007 0.404 . . . . 0.0 110.949 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -115.54 144.7 43.49 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.4 144.85 46.78 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.925 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.4 mt -115.51 120.28 64.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.18 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 31.3 mt -141.62 126.58 17.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.238 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.51 135.24 33.99 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.162 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.442 ' CD2' HD12 ' A' ' 6' ' ' ILE . 37.1 m-85 -127.02 128.37 46.23 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.051 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.9 p -87.1 123.06 31.75 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.669 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -64.91 154.08 86.96 Favored Pre-proline 0 C--O 1.233 0.232 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.264 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.39 127.34 14.79 Favored 'Cis proline' 0 C--N 1.35 0.616 0 C-N-CA 123.343 -1.524 . . . . 0.0 112.733 0.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.9 p -84.26 122.83 38.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.887 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.684 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -98.55 142.69 29.83 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.079 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.746 ' CE1' HD12 ' A' ' 42' ' ' LEU . 70.9 t80 -60.39 -42.41 95.84 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.987 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.416 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 16.2 mt-10 -61.56 -39.41 91.01 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.954 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -68.75 -44.28 74.07 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.015 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 24' ' ' LYS . 29.1 t -62.22 -48.02 90.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.838 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.416 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 10.8 pt-20 -63.78 -34.79 78.68 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.261 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.2 -48.38 80.51 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.047 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -63.48 -40.59 97.5 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.743 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 28' ' ' VAL . 41.8 t -64.97 -44.19 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.314 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 m -65.23 -38.88 91.75 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.965 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 m -71.55 -47.35 55.65 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.46 HG13 ' N ' ' A' ' 36' ' ' PHE . 13.5 p -59.92 -48.8 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.692 ' CE2' HD13 ' A' ' 79' ' ' LEU . 65.6 m-85 -84.01 -18.11 38.22 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.47 28.47 69.53 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.711 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.473 ' O ' HD12 ' A' ' 40' ' ' LEU . 1.2 pt20 -162.49 156.32 17.88 Favored Pre-proline 0 CA--C 1.529 0.158 0 CA-C-N 116.725 0.263 . . . . 0.0 110.922 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HB3' ' CE1' ' A' ' 90' ' ' HIS . 61.0 Cg_endo -73.04 107.12 2.29 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.664 2.243 . . . . 0.0 112.526 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.503 HD23 ' HB3' ' A' ' 79' ' ' LEU . 6.1 mp -108.65 126.44 52.98 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.029 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.44 135.4 39.41 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.842 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.746 HD12 ' CE1' ' A' ' 25' ' ' TYR . 73.5 mt -83.18 95.59 8.16 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.932 0.396 . . . . 0.0 110.536 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 -87.56 118.01 26.75 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.188 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.471 ' CD1' HD12 ' A' ' 51' ' ' ILE . 18.9 t80 -107.52 118.63 37.23 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.447 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.4 mmm -117.61 131.65 56.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.06 -48.74 7.83 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.586 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -173.15 -62.66 0.02 OUTLIER 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.482 179.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -111.29 -25.29 9.75 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.81 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.628 HD13 ' N ' ' A' ' 50' ' ' SER . 1.1 tm? -101.38 132.22 47.07 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 111.261 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.628 ' N ' HD13 ' A' ' 49' ' ' LEU . 1.0 OUTLIER -97.81 127.62 43.88 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.988 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.471 HD12 ' CD1' ' A' ' 44' ' ' TYR . 22.0 mt -118.11 131.51 70.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.011 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.4 tt -101.31 121.74 42.44 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.807 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.727 HD12 ' HB3' ' A' ' 42' ' ' LEU . 43.9 mt -79.14 100.64 7.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.65 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.52 -34.99 11.84 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.118 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -141.61 178.52 7.41 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.901 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -32.79 73.65 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.268 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.1 -47.68 71.52 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.648 0.261 . . . . 0.0 111.145 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -65.59 -46.2 80.31 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.0 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.456 HD13 HD13 ' A' ' 53' ' ' LEU . 10.3 tp -62.71 -42.46 99.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.146 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.24 -36.38 81.53 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.066 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.86 -36.48 83.4 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.651 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.549 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -65.22 -36.42 84.1 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.113 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.726 ' CD1' HD21 ' A' ' 75' ' ' LEU . 25.8 mm -64.56 -46.07 93.68 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.903 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.81 -40.25 69.34 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.267 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.549 HD12 ' HA ' ' A' ' 62' ' ' ALA . 11.7 mt -68.35 -45.63 82.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.893 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.3 tp -66.6 -42.62 86.61 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.027 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.85 -42.65 84.9 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.111 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -69.81 -30.4 67.92 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.925 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.5 t -69.2 146.69 52.18 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.817 0.342 . . . . 0.0 111.147 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.4 m -75.84 -20.83 57.82 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.617 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 76.1 p -94.43 38.69 1.09 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.792 0.329 . . . . 0.0 111.426 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.38 120.64 24.09 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.594 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.35 -68.18 0.19 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.963 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.31 173.19 8.54 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.872 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.726 HD21 ' CD1' ' A' ' 63' ' ' ILE . 5.3 mp -109.24 125.76 52.6 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.12 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 26.9 ttt180 -86.7 107.33 18.17 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.708 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.743 HG21 HD22 ' A' ' 42' ' ' LEU . 28.9 mt -129.7 131.89 66.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.963 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.4 mt -102.03 127.64 48.82 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.817 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.692 HD13 ' CE2' ' A' ' 36' ' ' PHE . 40.0 mt -93.74 119.67 33.02 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.101 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mp -144.95 144.89 31.3 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.917 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -80.25 100.01 8.12 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.82 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -105.36 34.96 3.01 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.629 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -130.01 94.08 3.63 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.892 0.377 . . . . 0.0 110.78 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -126.97 -38.58 2.01 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.155 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -96.25 34.03 1.66 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.662 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -174.24 146.75 1.14 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.409 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -156.95 37.27 0.3 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.148 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -161.66 160.74 29.02 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.65 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.04 47.21 7.54 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.093 0.473 . . . . 0.0 110.702 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.417 ' CE1' ' HB3' ' A' ' 39' ' ' PRO . 1.1 m-70 -70.69 -177.23 1.49 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.147 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -78.25 61.49 2.73 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.928 0.394 . . . . 0.0 110.705 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 58.3 87.67 0.07 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.375 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 4.2 p80 . . . . . 0 C--O 1.252 1.219 0 CA-C-O 118.72 -0.657 . . . . 0.0 111.221 179.679 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.842 0.353 . . . . 0.0 111.49 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.485 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 8.1 t -94.14 179.27 5.37 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.549 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.485 ' HB2' ' O ' ' A' ' 2' ' ' SER . 0.8 OUTLIER 71.83 128.28 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.071 -179.865 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.3 t -108.74 139.82 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.205 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.61 113.31 25.38 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.225 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.649 HD12 ' CD2' ' A' ' 19' ' ' PHE . 24.0 mt -110.14 123.93 66.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.823 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.418 ' HG3' ' HB3' ' A' ' 74' ' ' SER . 9.0 mttm -95.92 119.94 35.32 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.663 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.843 ' HB3' HD11 ' A' ' 79' ' ' LEU . 97.8 m-85 -106.58 141.26 38.16 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.098 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -120.82 125.75 48.35 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.126 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.441 ' HB2' HD12 ' A' ' 79' ' ' LEU . 5.6 t-160 -140.65 116.75 10.53 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.603 179.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 57.65 32.92 22.57 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.142 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.77 -14.25 60.63 Favored Glycine 0 CA--C 1.525 0.711 0 C-N-CA 120.876 -0.678 . . . . 0.0 113.137 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.76 129.02 34.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.963 0.382 . . . . 0.0 110.859 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.61 135.01 45.02 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.949 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -139.51 143.95 37.7 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.423 ' N ' HD12 ' A' ' 16' ' ' ILE . 3.8 mp -116.37 121.25 67.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.94 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.2 mm -123.4 136.35 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.347 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -100.22 134.12 43.62 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.011 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.649 ' CD2' HD12 ' A' ' 6' ' ' ILE . 81.0 m-85 -128.0 125.87 40.25 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.091 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.2 t -85.56 150.97 24.28 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.97 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -86.62 150.78 51.77 Favored Pre-proline 0 CA--C 1.529 0.173 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.428 179.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.09 127.22 14.61 Favored 'Cis proline' 0 C--N 1.349 0.582 0 C-N-CA 123.573 -1.428 . . . . 0.0 112.752 0.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.5 p -93.07 129.88 42.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.057 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.454 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -100.59 143.63 30.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.104 -179.713 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -57.36 -52.58 64.79 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.872 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.03 -35.27 74.73 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.036 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -62.39 -44.77 95.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.719 0.295 . . . . 0.0 110.987 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 24' ' ' LYS . 39.6 t -67.69 -48.43 76.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.52 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -62.75 -36.84 84.36 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.46 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -57.69 -45.03 86.18 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.026 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.671 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.6 OUTLIER -61.13 -46.48 90.41 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.776 179.793 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.653 HG11 HD22 ' A' ' 79' ' ' LEU . 33.8 t -61.65 -47.45 93.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.208 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 m -65.69 -38.74 90.09 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.388 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.0 m -71.5 -48.48 48.7 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 111.55 0.204 . . . . 0.0 111.55 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.671 HG23 ' O ' ' A' ' 31' ' ' LYS . 59.9 t -61.39 -50.06 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.474 0.178 . . . . 0.0 111.36 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.629 ' HE2' HD13 ' A' ' 79' ' ' LEU . 24.4 m-85 -80.74 -20.13 43.43 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.47 34.41 73.85 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.802 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.455 ' OE1' ' HB3' ' A' ' 81' ' ' SER . 1.1 pt20 -167.6 149.65 5.33 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.73 0.265 . . . . 0.0 111.238 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.65 126.84 8.44 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.76 2.307 . . . . 0.0 112.709 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.426 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.4 mp -133.79 144.51 49.07 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.919 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.34 130.17 37.23 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.636 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 53' ' ' LEU . 1.1 mp -81.6 116.74 21.5 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.083 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.412 ' ND1' HD21 ' A' ' 80' ' ' LEU . 3.8 m80 -102.03 121.26 41.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.186 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.554 ' HD2' HD11 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -94.62 128.78 41.5 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.794 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.2 ptt? -131.59 114.56 14.99 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.742 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -90.57 -66.01 0.96 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.718 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -146.04 -70.42 0.26 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.409 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -112.46 -16.0 12.98 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.62 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -110.7 139.78 45.67 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.802 0.334 . . . . 0.0 111.253 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.1 m -120.77 124.68 45.71 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.598 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.9 mt -114.96 134.44 58.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.024 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.432 HD23 ' N ' ' A' ' 53' ' ' LEU . 4.1 tt -92.0 129.37 37.97 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.185 -179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.554 HD11 ' HD2' ' A' ' 44' ' ' TYR . 8.2 mt -82.36 90.44 6.68 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.058 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -106.74 -33.67 7.53 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.158 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.05 167.08 11.47 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.062 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.36 -37.07 85.92 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.061 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -55.47 -37.59 67.97 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.238 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.481 ' HB3' HD23 ' A' ' 53' ' ' LEU . 2.0 t70 -65.52 -41.74 92.78 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.672 0.273 . . . . 0.0 110.819 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.438 HD12 HD22 ' A' ' 53' ' ' LEU . 0.6 OUTLIER -66.79 -42.29 86.21 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.979 179.73 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -68.79 -41.64 78.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.009 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -36.49 81.9 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.818 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.536 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -64.83 -40.43 95.18 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.369 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.0 mt -65.06 -41.44 91.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.035 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -53.41 -44.42 68.73 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.173 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 37.5 mt -68.85 -44.2 81.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.05 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.48 -43.41 97.38 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.925 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -60.51 -40.45 91.46 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.36 -32.84 73.21 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.16 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.3 t -89.33 107.63 19.17 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.291 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 12.9 t -70.64 -29.03 65.28 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.672 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 p -60.71 -61.72 2.38 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.0 ttt -76.32 115.76 16.37 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.767 0.318 . . . . 0.0 111.248 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.8 mttm -93.11 -37.02 12.36 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.426 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.418 ' HB3' ' HG3' ' A' ' 7' ' ' LYS . 1.7 m -110.72 166.17 11.23 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.625 0.25 . . . . 0.0 111.108 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.637 ' CD1' HG23 ' A' ' 6' ' ' ILE . 0.3 OUTLIER -116.86 136.7 52.75 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.107 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.435 ' O ' HD13 ' A' ' 77' ' ' ILE . 3.5 mtp85 -86.32 116.59 24.58 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.158 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.607 HD11 HD12 ' A' ' 75' ' ' LEU . 24.2 mm -126.65 129.84 71.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.227 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.3 mp -102.15 125.67 48.9 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.607 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.843 HD11 ' HB3' ' A' ' 8' ' ' PHE . 2.0 mt -98.08 129.44 44.91 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.089 -179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.412 HD21 ' ND1' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -149.62 135.41 18.65 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.253 179.822 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.455 ' HB3' ' OE1' ' A' ' 38' ' ' GLN . 81.6 p -85.69 131.07 34.4 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.456 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.55 35.87 1.74 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.732 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -157.37 85.74 0.93 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.046 0.45 . . . . 0.0 111.062 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.45 -5.96 45.56 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.607 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -66.27 81.69 0.09 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.084 0.469 . . . . 0.0 111.288 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -173.93 169.9 3.98 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.175 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -121.65 143.08 49.53 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.943 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -107.18 -34.73 7.04 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.019 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.71 -177.19 0.18 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 120.702 0.287 . . . . 0.0 111.19 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -80.83 92.6 6.12 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.914 0.388 . . . . 0.0 110.538 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.51 -179.62 3.87 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.28 -179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -104.81 142.7 34.26 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.208 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.553 -0.737 . . . . 0.0 111.084 179.636 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 120.639 0.257 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.4 p -169.52 78.93 0.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.42 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -162.83 104.25 1.03 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.143 -179.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -98.93 131.66 45.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.034 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.43 ' HE ' HG21 ' A' ' 16' ' ' ILE . 7.2 ttt180 -90.16 105.56 17.89 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.893 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.629 HG23 ' HB2' ' A' ' 75' ' ' LEU . 1.9 mp -111.15 135.13 51.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.056 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -104.25 121.23 42.87 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.698 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.518 ' HD2' HD11 ' A' ' 79' ' ' LEU . 11.3 m-85 -99.85 142.24 31.59 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.084 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -131.69 125.54 32.33 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -148.86 117.67 6.66 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.686 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 58.0 31.47 20.68 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.456 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.87 -14.44 58.62 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.087 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -85.08 106.98 16.95 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 117.013 0.406 . . . . 0.0 110.378 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -101.21 144.07 30.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.013 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -143.01 157.94 44.07 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.364 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.43 HG21 ' HE ' ' A' ' 5' ' ' ARG . 3.8 mp -115.98 123.07 70.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.821 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 30.9 mt -130.86 138.63 53.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.181 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.24 133.97 34.59 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.125 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -128.13 117.63 21.96 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 97.6 p -76.21 145.89 39.46 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.126 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -98.91 154.52 37.32 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.032 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.34 120.71 7.14 Favored 'Cis proline' 0 C--N 1.351 0.704 0 C-N-CA 123.335 -1.527 . . . . 0.0 112.796 0.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -75.57 129.46 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.266 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.422 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -97.73 139.29 33.82 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.973 -179.941 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -55.31 -44.25 75.62 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.765 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.71 -41.15 94.66 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.924 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.4 -44.44 96.43 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.116 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 24' ' ' LYS . 22.2 t -65.88 -48.63 81.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.823 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -58.44 -39.97 81.3 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.241 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -40.24 80.25 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.754 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.68 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.4 OUTLIER -68.54 -48.13 65.11 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.993 179.515 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 28' ' ' VAL . 23.2 t -60.02 -42.62 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.344 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.6 m -61.37 -39.0 89.04 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.924 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.9 m -71.49 -46.98 58.34 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 111.47 0.174 . . . . 0.0 111.47 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 31' ' ' LYS . 36.8 t -58.27 -50.05 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.474 ' CE2' HD13 ' A' ' 79' ' ' LEU . 24.9 m-85 -83.6 -24.67 31.39 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.17 28.25 58.59 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.848 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.503 ' O ' HD12 ' A' ' 40' ' ' LEU . 1.5 pt20 -173.08 159.63 3.49 Favored Pre-proline 0 N--CA 1.464 0.226 0 CA-C-N 116.712 0.256 . . . . 0.0 110.973 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.433 ' HD2' ' HB2' ' A' ' 38' ' ' GLN . 56.3 Cg_endo -71.23 109.73 2.66 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.631 2.221 . . . . 0.0 112.524 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.503 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.9 mp -115.59 154.82 28.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.091 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -98.17 141.9 30.52 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.779 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.443 ' N ' HD23 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -108.49 100.06 9.38 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.695 179.783 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.0 m170 -92.14 131.04 37.7 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.418 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -107.03 121.94 45.46 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.486 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 7.7 mmt -109.32 114.75 28.69 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.62 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -72.3 -56.58 5.26 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.734 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -170.77 -58.6 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.574 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -117.44 2.57 12.45 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.676 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.709 HD12 HD11 ' A' ' 51' ' ' ILE . 0.5 OUTLIER -131.76 159.59 38.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.784 0.326 . . . . 0.0 111.659 -179.851 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.87 125.08 49.84 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.262 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.709 HD11 HD12 ' A' ' 49' ' ' LEU . 28.0 mm -116.14 132.11 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.851 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -96.33 126.82 41.8 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.817 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.496 HD21 ' HA ' ' A' ' 59' ' ' LEU . 7.0 mt -87.56 92.11 8.98 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.761 0.315 . . . . 0.0 110.764 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.9 pttt -107.46 -34.38 7.07 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.416 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -131.54 171.04 13.9 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.712 0.291 . . . . 0.0 111.033 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -31.54 71.19 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.922 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -54.09 -44.77 71.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.664 0.269 . . . . 0.0 111.029 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.446 ' HB2' HD23 ' A' ' 53' ' ' LEU . 61.1 m-20 -67.21 -36.76 82.4 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.809 179.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.496 ' HA ' HD21 ' A' ' 53' ' ' LEU . 1.3 tp -68.86 -41.85 77.87 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.095 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.58 -41.1 96.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.066 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -62.99 -39.21 94.07 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.847 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.3 -43.67 97.17 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.078 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 43.9 mm -65.37 -41.49 91.34 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.826 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.48 -43.26 75.38 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.971 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.0 mt -67.83 -42.44 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.881 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.9 tp -67.36 -39.23 85.69 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.399 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.57 -37.51 86.45 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.695 0.283 . . . . 0.0 110.924 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -32.37 62.78 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.511 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.3 p -78.48 119.45 21.8 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.03 0.443 . . . . 0.0 111.162 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.49 -29.5 56.85 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.674 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.1 p -93.67 34.58 1.18 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 120.634 0.254 . . . . 0.0 111.678 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.5 mtm -149.98 123.21 8.93 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.667 0.27 . . . . 0.0 111.022 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.55 -46.97 2.35 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.684 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.1 t -83.65 174.09 10.81 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.951 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.629 ' HB2' HG23 ' A' ' 6' ' ' ILE . 2.3 mp -119.07 135.29 54.72 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.903 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.9 mtt85 -102.0 107.49 18.63 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.727 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 9.0 mt -129.58 131.79 66.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.868 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.07 119.48 38.86 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.604 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.518 HD11 ' HD2' ' A' ' 8' ' ' PHE . 2.6 mt -93.42 129.44 39.57 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.116 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mp -138.58 134.95 34.47 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.086 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.13 161.39 30.95 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.96 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 64.11 75.87 0.37 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.682 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -71.99 179.83 3.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.372 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 60.34 72.24 0.53 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.117 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.09 119.73 30.68 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.957 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.64 147.84 50.51 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.324 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.3 -35.27 67.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.117 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -118.69 60.49 0.8 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.826 0.346 . . . . 0.0 111.11 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -63.39 -56.86 12.82 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.658 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 65.62 106.04 0.04 OUTLIER 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.862 179.418 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -160.86 156.89 25.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.557 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -162.22 142.16 9.86 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.811 179.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 24.0 m80 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.043 -0.98 . . . . 0.0 111.36 -179.717 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 120.499 0.19 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 65.26 172.39 0.21 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.363 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 58.41 95.03 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.126 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -75.46 143.68 12.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.075 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.4 mtp85 -95.36 114.65 26.44 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.769 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.729 HD13 ' HD2' ' A' ' 19' ' ' PHE . 4.6 mp -115.4 134.74 57.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.269 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.69 127.47 47.09 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.785 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -107.46 138.46 43.63 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.059 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -130.47 124.18 31.41 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.105 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.54 ' HB2' HD12 ' A' ' 79' ' ' LEU . 1.0 OUTLIER -147.06 127.91 14.42 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.633 179.906 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.08 27.68 16.71 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.489 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.45 -13.98 60.78 Favored Glycine 0 CA--C 1.526 0.728 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.13 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -83.04 163.44 20.96 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 117.004 0.402 . . . . 0.0 111.119 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.1 mtt180 -120.65 153.03 37.42 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.251 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.1 141.15 28.55 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.02 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mt -111.73 119.02 59.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.877 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.16 130.34 34.24 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 120.925 0.393 . . . . 0.0 111.218 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.57 135.68 40.62 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.055 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.729 ' HD2' HD13 ' A' ' 6' ' ' ILE . 39.2 m-85 -122.93 126.65 47.65 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.11 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.3 m -72.63 138.56 46.81 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.015 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.26 152.68 38.71 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.964 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.2 132.31 26.89 Favored 'Cis proline' 0 C--N 1.349 0.594 0 C-N-CA 123.275 -1.552 . . . . 0.0 112.726 0.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -110.65 130.45 63.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.118 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.71 144.91 25.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.014 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -54.71 -37.4 65.81 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.193 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -59.35 -45.07 92.41 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.046 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.47 -44.21 95.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.105 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.494 ' O ' HG23 ' A' ' 32' ' ' VAL . 22.4 t -65.43 -48.82 81.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.891 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -56.68 -41.42 77.29 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.839 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -57.67 -42.32 83.33 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.737 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.642 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -66.8 -47.64 71.47 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.131 179.595 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 28' ' ' VAL . 25.5 t -57.53 -45.65 86.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.138 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.9 m -62.66 -38.78 91.67 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.087 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.3 m -71.48 -46.91 58.59 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.3 t -60.68 -49.92 82.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.702 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 35.4 m-85 -83.84 -21.96 31.87 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.54 -16.74 60.09 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 120.735 -0.745 . . . . 0.0 113.06 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.607 ' O ' HD12 ' A' ' 40' ' ' LEU . 11.5 pt20 -146.11 158.0 49.0 Favored Pre-proline 0 CA--C 1.531 0.227 0 CA-C-N 116.846 0.323 . . . . 0.0 110.758 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.99 129.61 14.46 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.573 2.182 . . . . 0.0 112.489 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.607 HD12 ' O ' ' A' ' 38' ' ' GLN . 4.7 mp -120.86 151.91 39.06 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.36 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.24 137.64 32.17 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.611 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.522 HD22 HG21 ' A' ' 77' ' ' ILE . 3.1 mt -98.76 107.03 19.37 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.942 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.457 ' CE1' HD13 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -93.75 114.89 27.27 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.048 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -95.12 129.07 42.36 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 21.8 ptm -127.11 121.63 31.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.712 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -86.34 -60.05 2.11 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.358 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -154.12 -67.97 0.14 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.273 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.59 -21.39 12.15 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.683 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mp -104.65 140.38 38.12 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.768 0.318 . . . . 0.0 111.311 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.91 122.36 46.75 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.827 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.5 mt -113.95 132.52 62.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.83 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.457 HD13 ' CE1' ' A' ' 43' ' ' HIS . 31.2 tp -93.3 134.84 35.1 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.759 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 56.1 mt -87.37 107.57 18.59 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.997 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.57 -35.72 6.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.306 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -136.87 180.0 6.04 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.39 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.405 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 4.8 tp60 -64.32 -34.33 77.88 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.122 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.04 -40.35 73.36 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.796 -0.183 . . . . 0.0 111.283 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -66.36 -50.02 64.96 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.422 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.466 HD12 ' N ' ' A' ' 60' ' ' ASP . 3.9 pp -69.79 -34.38 73.65 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.968 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.78 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.2 t0 -61.31 -43.76 98.33 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.62 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -70.22 -32.75 70.77 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.07 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.821 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.81 -39.32 93.94 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.319 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.78 HD12 ' HA ' ' A' ' 60' ' ' ASP . 5.8 mt -61.08 -47.37 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.736 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -53.18 -37.32 61.81 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.157 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.821 HD12 ' HA ' ' A' ' 62' ' ' ALA . 17.0 mt -64.91 -38.38 82.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.067 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.52 HD11 ' HG ' ' A' ' 75' ' ' LEU . 14.5 mt -66.55 -46.99 74.26 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.984 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.12 -38.16 85.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.199 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -28.74 67.91 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.47 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.1 p -62.44 165.83 5.74 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.956 0.407 . . . . 0.0 111.519 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.88 -43.16 18.56 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.198 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 57.6 p -127.62 -35.06 2.16 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -50.45 91.45 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.181 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -106.73 -32.35 8.02 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.168 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.6 p -69.12 -179.85 1.68 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.63 0.252 . . . . 0.0 111.09 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.553 ' HB3' HD11 ' A' ' 77' ' ' ILE . 3.1 mp -129.69 117.64 20.65 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.723 0.297 . . . . 0.0 111.525 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -86.89 106.89 18.08 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.246 179.356 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.553 HD11 ' HB3' ' A' ' 75' ' ' LEU . 2.6 mt -129.78 130.8 66.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.111 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -103.9 129.61 51.44 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.578 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.702 HD13 ' CZ ' ' A' ' 36' ' ' PHE . 4.9 mt -93.63 129.11 40.02 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.25 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.419 HD12 ' C ' ' A' ' 79' ' ' LEU . 5.8 mp -138.3 134.08 33.86 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.072 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.7 m -63.18 115.42 4.48 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.297 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -112.66 33.36 5.02 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.305 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.87 54.45 2.43 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.035 0.445 . . . . 0.0 110.871 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -117.19 -42.59 2.9 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.007 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -86.02 111.43 20.29 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.106 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.1 mt -107.44 -39.6 5.6 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.29 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 67.41 101.96 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.671 0.388 . . . . 0.0 111.602 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.438 ' O ' ' HB2' ' A' ' 89' ' ' HIS . 0.1 OUTLIER -107.56 -173.88 2.39 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.17 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.438 ' HB2' ' O ' ' A' ' 88' ' ' HIS . 39.8 m-70 70.4 175.54 0.29 Allowed 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 13.8 p80 -59.36 -31.34 69.12 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.11 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.68 127.0 29.33 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.121 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 63.75 89.45 0.09 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.355 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 12.3 t-160 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.164 -0.922 . . . . 0.0 110.755 179.987 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 120.551 0.215 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 m -164.39 81.85 0.4 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.784 0.326 . . . . 0.0 111.162 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -170.94 114.89 0.43 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.772 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.28 138.99 52.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.148 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.61 113.73 25.22 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.031 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.481 HD12 ' CD2' ' A' ' 19' ' ' PHE . 21.3 mt -104.93 117.44 50.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.974 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -98.41 127.16 44.22 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.022 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.753 ' CD1' HD12 ' A' ' 17' ' ' ILE . 33.5 m-85 -110.71 147.87 33.48 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.025 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -129.56 132.76 46.91 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.223 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.449 ' HB2' HD11 ' A' ' 79' ' ' LEU . 12.3 t-80 -148.19 112.97 5.41 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.812 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 56.39 36.74 28.02 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.396 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.43 -13.96 62.42 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.218 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -84.34 122.01 28.33 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.984 0.392 . . . . 0.0 110.812 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -105.38 146.03 29.99 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.135 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.57 138.51 24.76 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.136 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.2 mp -105.75 122.1 58.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.999 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.753 HD12 ' CD1' ' A' ' 8' ' ' PHE . 6.1 mt -126.27 127.45 70.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.923 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.3 140.76 29.38 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.315 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.481 ' CD2' HD12 ' A' ' 6' ' ' ILE . 8.0 m-85 -137.35 119.85 15.97 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.76 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.0 m -75.63 134.62 40.59 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.081 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.401 ' HA ' ' N ' ' A' ' 23' ' ' VAL . 7.3 mtm180 -75.77 150.42 83.98 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.226 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.06 120.76 7.33 Favored 'Cis proline' 0 C--N 1.349 0.577 0 C-N-CA 123.284 -1.549 . . . . 0.0 112.283 -0.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.401 ' N ' ' HA ' ' A' ' 21' ' ' ARG . 12.6 p -73.77 127.66 35.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.983 0.42 . . . . 0.0 110.993 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.97 130.57 46.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.945 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -55.87 -35.99 67.09 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.997 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.19 -44.49 96.49 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.152 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -66.26 -44.8 82.63 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.703 0.287 . . . . 0.0 111.006 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.1 t -67.16 -46.51 84.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.95 179.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -61.4 -42.51 98.84 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.304 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -58.16 -41.87 84.73 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.011 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.776 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -61.14 -46.98 88.31 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.881 179.602 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.0 t -66.25 -45.55 89.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.12 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.1 m -60.09 -38.71 83.74 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.1 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 59.7 m -70.61 -43.58 69.02 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 31' ' ' LYS . 62.1 t -58.47 -49.87 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-O 120.526 0.203 . . . . 0.0 111.311 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -83.7 -28.13 28.51 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.04 28.49 34.1 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.668 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.588 ' O ' HD12 ' A' ' 40' ' ' LEU . 8.9 pt20 -168.94 158.4 7.72 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-O 120.535 0.207 . . . . 0.0 110.899 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.03 124.7 10.79 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.943 2.429 . . . . 0.0 112.217 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.627 HD22 HD13 ' A' ' 79' ' ' LEU . 4.0 mp -117.21 151.54 36.68 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.175 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.25 120.99 40.75 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.928 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.633 HD23 HG21 ' A' ' 77' ' ' ILE . 4.0 mp -83.52 125.88 32.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.13 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -113.67 115.57 28.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -111.67 121.85 46.22 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.696 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -115.52 133.27 56.19 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.757 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -74.17 -56.18 5.21 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.77 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -170.04 -57.57 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.39 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.64 -30.32 10.04 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.316 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.6 mt -108.89 145.31 35.57 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.968 0.413 . . . . 0.0 111.389 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 30.2 t -109.78 127.98 55.0 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.952 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.9 mt -118.42 134.44 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.978 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.602 HD22 ' HG2' ' A' ' 54' ' ' LYS . 2.1 tt -90.69 128.98 36.83 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.841 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.569 HD12 ' HB3' ' A' ' 42' ' ' LEU . 47.5 mt -81.33 96.96 7.48 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.962 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.602 ' HG2' HD22 ' A' ' 52' ' ' LEU . 5.9 mmtp -108.72 -37.85 5.79 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.226 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -125.96 175.81 7.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.099 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.411 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 2.6 mt-30 -62.97 -32.63 74.01 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.904 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.25 -39.12 72.07 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.353 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.482 ' HB3' HD23 ' A' ' 53' ' ' LEU . 9.2 m-20 -64.16 -50.43 68.2 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.495 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.421 HD12 ' C ' ' A' ' 59' ' ' LEU . 3.6 pp -71.75 -34.45 69.51 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.086 -0.246 . . . . 0.0 110.926 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -63.01 -43.25 99.29 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.786 0.326 . . . . 0.0 111.027 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -33.26 73.71 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.91 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.96 99.69 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.257 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.639 ' HA ' HD12 ' A' ' 66' ' ' LEU . 16.0 mt -63.88 -42.58 96.31 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.737 179.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -54.35 -41.83 69.55 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.872 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 29.2 mt -66.7 -41.04 87.48 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.983 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.715 HD13 HD11 ' A' ' 75' ' ' LEU . 6.0 mt -65.19 -40.32 94.07 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.113 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -66.75 -32.02 73.04 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.171 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -33.77 76.57 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.48 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.7 t -104.76 134.22 48.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.452 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 94.3 p -77.33 -37.29 52.76 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.989 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.5 p -63.27 -35.85 81.7 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.135 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.07 121.49 27.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.698 0.285 . . . . 0.0 111.068 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -132.17 -52.61 0.96 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.996 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.2 m -70.01 177.94 2.95 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.134 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.715 HD11 HD13 ' A' ' 66' ' ' LEU . 1.1 mp -131.9 119.03 20.61 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.157 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -96.65 107.02 19.39 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.32 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.633 HG21 HD23 ' A' ' 42' ' ' LEU . 29.5 mt -128.69 132.19 67.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.904 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.6 mp -102.08 130.72 48.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.626 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.627 HD13 HD22 ' A' ' 40' ' ' LEU . 2.0 pp -117.86 136.05 53.7 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.958 0.409 . . . . 0.0 111.215 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mp -137.74 158.45 44.34 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.944 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.9 t -59.02 110.34 1.02 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.099 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -109.99 39.15 2.21 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.167 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -106.99 32.82 4.31 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.711 0.291 . . . . 0.0 110.933 179.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 65.04 21.9 12.32 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.312 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 71.48 141.82 0.05 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.99 0.424 . . . . 0.0 111.623 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.0 tp -139.38 37.74 2.07 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.395 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 51.56 75.48 0.2 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.632 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -138.46 80.46 1.79 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 0.0 110.922 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 30.6 m80 -122.82 -49.51 1.98 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.883 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 33.6 p-80 -161.85 89.61 0.74 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.932 0.396 . . . . 0.0 111.386 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -165.45 126.72 1.96 Allowed 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.157 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 46.2 m80 -83.73 -180.0 7.45 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.719 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.115 -0.945 . . . . 0.0 111.444 -179.764 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 120.831 0.348 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.45 179.94 5.28 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.812 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 68.56 101.5 0.05 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.236 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.407 ' O ' HD12 ' A' ' 6' ' ' ILE . 22.2 t -101.56 129.33 52.88 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.783 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -90.6 105.58 17.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.056 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.518 HD13 ' HD2' ' A' ' 19' ' ' PHE . 3.5 mp -114.99 129.07 71.8 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.208 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.4 mtpt -100.34 126.81 46.73 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.634 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.485 ' HB3' HD11 ' A' ' 79' ' ' LEU . 48.7 m-85 -114.89 127.56 55.77 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.022 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -122.0 131.2 53.87 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.217 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -145.5 128.73 16.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.694 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.73 30.67 20.25 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.221 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.96 -13.96 59.95 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.982 -0.628 . . . . 0.0 113.065 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.33 116.57 28.4 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 117.001 0.401 . . . . 0.0 110.848 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -104.93 135.87 45.48 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.233 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -134.2 154.27 51.35 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.248 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.413 ' O ' HD13 ' A' ' 17' ' ' ILE . 7.4 mt -115.31 122.25 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.344 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.413 HD13 ' O ' ' A' ' 16' ' ' ILE . 26.4 mm -127.49 128.66 70.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.145 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.91 129.05 36.32 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.694 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.518 ' HD2' HD13 ' A' ' 6' ' ' ILE . 11.9 m-85 -117.34 117.61 29.99 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.386 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.02 157.14 38.07 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.173 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.556 ' NH2' HG21 ' A' ' 63' ' ' ILE . 5.9 mmt180 -99.84 151.31 37.44 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.469 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.35 145.11 81.25 Favored 'Cis proline' 0 C--N 1.35 0.608 0 C-N-CA 123.414 -1.494 . . . . 0.0 112.801 0.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.6 p -107.42 124.49 63.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.106 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' O ' HG23 ' A' ' 28' ' ' VAL . 18.7 mmtm -102.56 149.88 23.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.236 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -58.11 -48.17 81.03 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.757 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.35 -42.28 95.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.227 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -62.08 -44.33 96.9 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.059 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' ' 24' ' ' LYS . 38.3 t -68.83 -48.72 69.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.785 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -40.06 84.62 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.2 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -58.18 -39.89 80.07 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.816 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -70.97 -41.03 71.57 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.752 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 28' ' ' VAL . 37.8 t -66.64 -42.58 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.186 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 t -65.71 -38.5 89.36 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.146 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.9 m -71.31 -46.79 59.85 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.436 HG13 ' N ' ' A' ' 36' ' ' PHE . 13.4 p -60.38 -47.95 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 -179.412 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.661 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 33.1 m-85 -84.08 -18.09 38.08 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.43 22.63 64.46 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 120.865 -0.683 . . . . 0.0 113.118 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.518 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -172.26 149.87 2.22 Favored Pre-proline 0 N--CA 1.463 0.216 0 CA-C-N 116.863 0.331 . . . . 0.0 110.94 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -74.23 106.9 2.32 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.569 2.179 . . . . 0.0 112.125 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.2 mp -104.87 140.04 38.73 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.96 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.47 140.75 41.36 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.017 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.661 ' HB2' HD12 ' A' ' 53' ' ' LEU . 3.3 mp -101.95 118.52 37.08 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.062 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -105.3 129.69 53.59 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.299 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -109.79 129.01 55.67 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.656 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.1 mtt -125.48 132.41 52.66 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.682 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -97.61 -65.83 0.94 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.686 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -144.87 -71.51 0.27 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.442 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -111.58 -18.23 12.86 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.527 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.3 mp -105.63 139.96 39.43 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.803 0.335 . . . . 0.0 111.35 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.8 m -114.03 125.8 54.4 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.828 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.1 mt -114.0 132.54 62.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.099 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.644 HD22 ' HE2' ' A' ' 54' ' ' LYS . 8.6 tt -92.38 128.08 38.1 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.8 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.834 HD13 HD21 ' A' ' 59' ' ' LEU . 71.9 mt -71.51 100.03 2.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.564 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.644 ' HE2' HD22 ' A' ' 52' ' ' LEU . 5.5 mmtt -90.2 -49.25 6.66 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.424 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -149.06 -170.2 3.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.869 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.69 -32.34 65.34 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.255 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -53.76 -45.66 70.69 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.849 0.357 . . . . 0.0 110.799 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.03 -42.69 84.43 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.166 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.834 HD21 HD13 ' A' ' 53' ' ' LEU . 77.5 mt -67.82 -40.53 83.78 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.272 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.776 ' HA ' HD12 ' A' ' 63' ' ' ILE . 3.0 t0 -61.66 -43.46 98.81 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.06 -179.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -63.39 -39.4 94.41 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.388 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.64 98.93 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.188 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.776 HD12 ' HA ' ' A' ' 60' ' ' ASP . 6.2 mt -63.78 -45.73 96.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.883 179.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -44.85 78.32 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.041 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.3 mt -67.09 -39.48 83.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.989 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.857 HD22 HD21 ' A' ' 75' ' ' LEU . 9.4 tp -61.99 -45.45 93.59 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.057 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -56.92 -37.24 71.2 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.256 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -33.24 64.62 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.101 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.3 t -89.07 92.68 9.31 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.256 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 40.6 t -62.99 -34.75 78.2 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.054 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.06 -33.78 67.6 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.318 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.96 129.42 42.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.097 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 47.5 mttt -111.71 -44.69 3.45 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.887 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.472 ' C ' HD22 ' A' ' 75' ' ' LEU . 60.5 p -101.62 179.04 4.46 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.187 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.857 HD21 HD22 ' A' ' 66' ' ' LEU . 4.0 mm? -123.25 128.93 50.68 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.062 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -88.47 108.57 19.45 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.654 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.9 mt -127.26 131.3 70.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.189 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -102.02 128.29 48.52 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.699 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.661 HD13 ' CZ ' ' A' ' 36' ' ' PHE . 2.5 mt -94.02 122.35 36.43 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.148 -179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.1 mp -134.1 134.24 42.04 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.114 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m -68.64 124.18 22.91 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.996 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -143.76 62.63 1.36 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.068 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -99.65 44.94 1.0 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.765 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -102.73 32.09 3.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.852 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -157.23 172.14 19.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.719 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.2 mp -97.24 -82.12 0.41 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.852 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 173.94 -176.53 0.08 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 122.321 0.248 . . . . 0.0 110.496 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -116.42 93.99 4.45 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.797 0.332 . . . . 0.0 110.944 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.04 135.57 17.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.239 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -172.42 96.65 0.15 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.225 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -97.39 -38.26 9.69 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.105 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -117.38 -67.03 1.02 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.905 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.3 t60 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.897 -179.949 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 120.691 0.282 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m -106.32 131.05 54.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.068 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 68.41 110.57 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.673 0.608 . . . . 0.0 111.342 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.4 t -99.59 131.58 46.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.208 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -88.96 119.93 29.92 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.746 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.5 mt -115.66 133.63 61.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.192 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.8 mttp -99.43 125.0 45.07 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.834 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -114.11 137.22 52.02 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.182 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.48 133.36 55.42 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.392 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -146.13 116.8 7.62 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.265 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 57.97 33.99 23.8 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.391 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.24 13.31 80.98 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 121.029 -0.605 . . . . 0.0 113.348 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -109.49 120.36 42.27 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 117.237 0.519 . . . . 0.0 110.518 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -92.75 135.21 34.31 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.978 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.38 143.39 50.74 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.036 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.422 ' O ' HD13 ' A' ' 17' ' ' ILE . 3.6 mt -110.12 116.02 51.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.199 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.422 HD13 ' O ' ' A' ' 16' ' ' ILE . 26.3 mm -128.36 131.46 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.046 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.47 129.88 36.59 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.007 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -127.15 118.38 24.23 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.934 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.95 145.08 34.21 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.972 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -99.85 149.56 36.06 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.171 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.77 121.65 7.95 Favored 'Cis proline' 0 C--N 1.35 0.655 0 C-N-CA 123.361 -1.516 . . . . 0.0 112.899 0.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.7 p -89.86 130.48 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.855 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -84.09 138.25 33.14 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.126 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -55.99 -45.04 79.13 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.234 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.57 -39.62 80.82 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.938 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -63.4 -44.59 94.24 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.047 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 32' ' ' VAL . 21.5 t -67.87 -48.88 73.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.016 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -41.18 96.08 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.503 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -45.39 87.38 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.766 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.651 ' O ' HG23 ' A' ' 35' ' ' VAL . 1.4 tptm -61.59 -47.58 84.84 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.769 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.58 HG11 HD22 ' A' ' 79' ' ' LEU . 39.1 t -58.93 -48.9 84.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-O 120.668 0.271 . . . . 0.0 110.964 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.4 m -64.28 -39.03 93.11 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.472 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.3 m -71.82 -48.19 48.01 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 31' ' ' LYS . 65.5 t -60.85 -48.83 87.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 -179.271 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.439 ' CE2' HD13 ' A' ' 79' ' ' LEU . 52.5 m-85 -83.28 -22.09 33.11 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.67 -7.73 81.13 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.887 -0.673 . . . . 0.0 113.34 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.669 ' O ' HD12 ' A' ' 40' ' ' LEU . 16.1 mt-30 -131.67 145.57 58.09 Favored Pre-proline 0 CA--C 1.529 0.152 0 CA-C-N 117.279 0.539 . . . . 0.0 110.984 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -75.06 94.4 0.96 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.57 2.18 . . . . 0.0 112.211 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.669 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.6 mp -94.68 135.98 35.52 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.888 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.577 ' CG ' HD11 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -76.16 140.47 41.75 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.962 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 mt -87.3 100.19 12.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.596 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.521 ' CE1' HD13 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -95.44 117.76 30.95 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.497 -179.382 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -107.07 115.94 31.06 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.361 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.4 ptm -101.3 134.88 43.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.77 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -89.62 -45.46 9.34 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.87 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -173.16 -68.36 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.43 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -108.99 -24.5 11.18 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.505 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 mp -105.03 137.94 42.0 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.789 0.328 . . . . 0.0 111.302 -179.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 p -95.62 124.42 39.64 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.596 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.7 134.37 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.735 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.577 HD11 ' CG ' ' A' ' 41' ' ' ASP . 14.0 tp -102.74 130.84 49.82 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.743 0.306 . . . . 0.0 110.957 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.467 HD21 ' HA ' ' A' ' 59' ' ' LEU . 8.1 mt -78.07 93.35 4.49 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.852 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.15 -37.46 12.1 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.155 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -134.83 171.55 14.22 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.835 0.35 . . . . 0.0 111.337 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.1 tp60 -60.72 -31.61 70.9 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.363 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -52.97 -45.86 67.99 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.773 0.321 . . . . 0.0 110.506 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.439 ' HB3' HD23 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -63.16 -39.47 94.76 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.239 179.591 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.467 ' HA ' HD21 ' A' ' 53' ' ' LEU . 17.7 tp -66.29 -42.98 87.58 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.143 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.596 ' HA ' HD12 ' A' ' 63' ' ' ILE . 3.3 m-20 -61.49 -43.12 99.43 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.836 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.66 -40.63 97.68 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.469 179.11 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.42 -42.93 99.81 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.666 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.596 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.7 mt -63.3 -44.17 99.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 120.521 0.2 . . . . 0.0 110.834 179.801 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -55.79 -43.73 77.1 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.253 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.6 mt -68.87 -41.74 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.933 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.478 HD13 ' HG ' ' A' ' 75' ' ' LEU . 1.5 tp -60.68 -45.05 95.64 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.012 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -58.62 -41.74 86.63 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.996 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.0 ttp85 -71.29 -33.57 69.84 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.611 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.2 p -82.57 103.03 11.8 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.847 0.356 . . . . 0.0 111.284 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 59.8 m -77.91 -38.2 46.2 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.281 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 p -61.96 -33.22 73.88 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.607 0.241 . . . . 0.0 111.562 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.0 tpt -63.17 150.29 43.27 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.99 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.34 105.25 8.41 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.705 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.9 m 66.04 -178.56 0.19 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.097 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.478 ' HG ' HD13 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -98.84 123.42 43.08 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.95 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.33 107.14 18.99 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.835 0.35 . . . . 0.0 110.633 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.6 mt -128.1 131.16 69.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.805 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -102.0 124.65 47.98 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.555 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.58 HD22 HG11 ' A' ' 32' ' ' VAL . 14.5 mt -93.63 133.28 37.13 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.211 -179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.439 HD21 ' ND1' ' A' ' 43' ' ' HIS . 0.4 OUTLIER -140.21 136.16 33.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.367 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.73 151.84 46.64 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.492 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.33 33.28 5.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.568 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.79 141.69 2.32 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.582 0.23 . . . . 0.0 111.137 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.18 67.32 1.86 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.985 0.422 . . . . 0.0 111.032 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -148.74 78.31 1.4 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.786 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.606 HD22 HE22 ' A' ' 38' ' ' GLN . 0.6 OUTLIER -155.8 42.06 0.41 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.155 179.836 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -150.1 -61.13 0.2 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.806 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -87.94 102.49 14.77 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.743 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.73 132.04 9.24 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.305 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -109.88 -37.91 5.5 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.256 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -85.93 120.38 27.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.609 0.242 . . . . 0.0 110.795 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -87.17 -179.67 6.49 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.012 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.696 -179.908 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.9 m -158.72 158.21 33.23 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.422 0.153 . . . . 0.0 110.784 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 57.89 87.85 0.06 Allowed 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.222 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -87.18 135.31 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.263 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.2 mtm-85 -92.93 124.5 36.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.913 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.508 HD12 ' HD1' ' A' ' 19' ' ' PHE . 2.8 mt -113.62 136.79 48.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.151 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -95.65 119.74 34.69 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.864 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.676 ' CD2' HD21 ' A' ' 79' ' ' LEU . 20.5 m-85 -107.71 136.69 47.03 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.907 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -127.42 132.1 50.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.826 0.346 . . . . 0.0 111.551 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.7 t-160 -144.58 123.89 13.03 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.55 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 57.5 35.09 25.46 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.062 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 84.01 -14.19 45.06 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.464 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.83 149.26 37.91 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 117.193 0.497 . . . . 0.0 111.198 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -110.44 135.17 51.55 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.058 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -140.8 143.03 34.61 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.739 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.0 mt -118.06 118.13 57.16 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.996 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.4 mp -126.65 127.02 69.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.242 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.9 146.44 23.75 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.118 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.508 ' HD1' HD12 ' A' ' 6' ' ' ILE . 53.8 m-85 -135.27 134.66 40.18 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.064 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -81.72 125.77 31.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.906 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 ptt180 -93.46 153.46 41.37 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.059 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.1 119.62 6.32 Favored 'Cis proline' 0 C--N 1.351 0.703 0 C-N-CA 123.429 -1.488 . . . . 0.0 112.838 0.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -99.88 130.44 48.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.017 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.6 143.12 31.24 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.779 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -57.1 -36.17 70.31 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.926 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -59.18 -44.76 92.17 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.717 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.72 -40.39 95.25 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.9 t -67.8 -49.01 73.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.114 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -59.32 -39.79 84.23 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.927 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -40.71 89.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.823 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.731 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -66.04 -48.21 71.83 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.223 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 44.1 t -59.69 -43.62 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.245 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.6 m -60.66 -38.98 86.66 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.951 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.7 m -71.76 -44.45 64.03 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 111.461 0.171 . . . . 0.0 111.461 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 31' ' ' LYS . 34.5 t -59.52 -50.18 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-O 120.49 0.186 . . . . 0.0 111.444 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.513 ' CE2' HD13 ' A' ' 79' ' ' LEU . 34.1 m-85 -83.71 -26.57 29.67 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -179.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.24 -11.13 61.84 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.926 -0.654 . . . . 0.0 113.145 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.451 ' O ' HD12 ' A' ' 40' ' ' LEU . 1.6 mp0 -141.54 156.96 66.46 Favored Pre-proline 0 N--CA 1.465 0.283 0 CA-C-N 116.978 0.389 . . . . 0.0 110.702 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.401 ' HD2' ' HB3' ' A' ' 38' ' ' GLN . 56.6 Cg_endo -71.16 111.68 3.13 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.586 2.191 . . . . 0.0 112.524 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.451 HD12 ' O ' ' A' ' 38' ' ' GLN . 6.4 mp -101.68 157.92 16.48 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -99.89 138.05 37.5 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.968 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.601 HD23 HG21 ' A' ' 77' ' ' ILE . 3.7 mp -91.79 112.63 24.63 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.994 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -103.05 111.81 24.34 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.117 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.549 ' HE2' HD12 ' A' ' 75' ' ' LEU . 13.6 t80 -104.35 117.44 34.19 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.591 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 6.4 mtp -123.49 126.53 46.9 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.824 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -74.0 -59.59 2.65 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.43 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -170.22 -54.75 0.02 OUTLIER 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.431 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -104.32 -31.82 9.37 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.498 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.5 mp -108.76 144.25 36.83 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.79 0.328 . . . . 0.0 111.329 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.2 m -113.59 123.48 50.07 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.994 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -114.53 133.35 60.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.916 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.0 tt -93.65 124.73 37.84 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.982 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.83 HD23 ' HB3' ' A' ' 58' ' ' ASP . 4.2 mt -75.89 94.44 3.35 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.454 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -85.47 -34.31 21.65 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.416 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -160.51 -169.83 2.58 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.776 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -61.2 -29.82 70.04 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.493 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.95 -47.08 68.37 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.795 0.331 . . . . 0.0 110.725 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.83 ' HB3' HD23 ' A' ' 53' ' ' LEU . 1.7 t70 -67.64 -40.47 84.59 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.004 179.441 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 tp -66.8 -37.47 84.61 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.277 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.834 ' HA ' HD12 ' A' ' 63' ' ' ILE . 4.5 t70 -61.18 -42.79 99.19 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.12 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.92 -35.64 80.46 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.613 179.4 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -37.36 86.84 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.055 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.834 HD12 ' HA ' ' A' ' 60' ' ' ASP . 7.9 mt -63.83 -40.76 90.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.956 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -53.31 -45.39 68.96 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.864 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.7 mt -69.04 -36.38 73.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.115 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.941 HD22 HD21 ' A' ' 75' ' ' LEU . 22.1 tp -68.91 -41.98 77.48 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.87 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -62.42 -42.39 99.41 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.218 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.2 ptm85 -71.66 -30.46 65.75 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.553 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.7 p -88.99 108.95 19.86 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.892 0.377 . . . . 0.0 111.052 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.2 m -76.07 -34.61 59.57 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.23 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 81.5 p -63.81 -35.0 79.18 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.348 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.8 tpp -84.54 158.67 20.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.959 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.3 tttt -145.6 -54.8 0.29 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.084 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . 0.51 ' C ' HD22 ' A' ' 75' ' ' LEU . 78.7 p -93.08 173.9 7.5 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.827 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.941 HD21 HD22 ' A' ' 66' ' ' LEU . 3.8 mm? -122.88 131.04 53.57 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.991 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.427 ' O ' HD13 ' A' ' 77' ' ' ILE . 11.2 mtm180 -86.55 109.21 18.96 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.984 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.601 HG21 HD23 ' A' ' 42' ' ' LEU . 17.4 mm -124.88 132.38 71.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.088 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.632 HD23 HD11 ' A' ' 80' ' ' LEU . 3.5 tp -101.97 131.52 48.33 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.554 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.676 HD21 ' CD2' ' A' ' 8' ' ' PHE . 1.3 mt -102.19 119.68 39.2 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.051 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.632 HD11 HD23 ' A' ' 78' ' ' LEU . 2.2 mp -141.3 145.39 35.44 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.678 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.4 t -63.58 120.37 11.62 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.951 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -152.98 48.21 0.71 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.28 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -148.42 96.07 2.55 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.241 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.54 43.31 2.93 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.215 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 67.3 169.69 0.25 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.279 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 mp -77.52 -52.34 9.23 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.958 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 53.96 66.91 1.1 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.461 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -90.48 -62.31 1.49 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.014 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 68.0 144.5 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.86 0.362 . . . . 0.0 111.397 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -108.09 98.72 8.24 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.155 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -151.97 97.89 2.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.826 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -98.21 -42.82 7.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.028 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.756 -179.996 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 120.804 0.335 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.2 t -162.28 157.67 23.19 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.88 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.41 ' HA ' ' HA ' ' A' ' 20' ' ' SER . 8.4 t0 -72.39 108.57 5.56 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.597 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.7 t -99.97 127.37 52.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.959 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.92 121.76 29.85 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.891 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.538 HD12 ' CD2' ' A' ' 19' ' ' PHE . 31.1 mt -111.61 130.08 65.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.965 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -103.72 113.3 26.72 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.734 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.674 ' HB3' HD11 ' A' ' 79' ' ' LEU . 64.5 m-85 -97.14 143.95 27.45 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.088 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -135.59 127.55 29.55 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.197 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -147.85 118.14 7.35 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.552 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 58.74 35.31 24.3 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.095 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.01 6.79 89.22 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 120.949 -0.643 . . . . 0.0 113.249 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -100.59 111.09 23.29 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 117.162 0.481 . . . . 0.0 110.792 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.3 ptt85 -94.64 141.66 28.35 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.197 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.4 mtt85 -143.72 141.24 30.39 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.054 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 21.8 mt -112.62 128.0 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.185 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.113 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.7 mp -134.07 137.82 51.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.226 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.8 135.85 33.45 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.073 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.538 ' CD2' HD12 ' A' ' 6' ' ' ILE . 75.0 m-85 -135.67 116.84 14.44 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.148 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' ASP . 0.3 OUTLIER -93.14 135.24 34.51 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.975 179.692 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mtt180 -78.55 155.73 78.52 Favored Pre-proline 0 N--CA 1.463 0.193 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.933 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.93 125.56 11.46 Favored 'Cis proline' 0 C--N 1.35 0.64 0 C-N-CA 123.406 -1.498 . . . . 0.0 112.494 -0.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.0 p -108.04 128.5 63.37 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.004 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.4 mttt -92.83 143.22 26.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.166 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.401 ' HB2' ' HG2' ' A' ' 56' ' ' GLN . 72.4 t80 -56.48 -39.44 73.23 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.833 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -64.73 -39.38 93.54 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.937 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -44.19 96.94 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.935 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.66 ' O ' HG23 ' A' ' 32' ' ' VAL . 21.9 t -68.73 -48.04 73.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.051 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -59.99 -40.04 87.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.145 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.48 -39.99 81.49 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.665 179.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.702 ' O ' HG23 ' A' ' 35' ' ' VAL . 14.8 tttt -69.13 -46.56 67.34 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.45 179.242 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 28' ' ' VAL . 18.0 t -59.76 -48.52 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.399 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -60.77 -38.46 85.33 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.491 -179.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 60.8 m -69.83 -45.39 67.93 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.682 0.252 . . . . 0.0 111.682 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.9 t -60.02 -49.27 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.492 0.186 . . . . 0.0 111.352 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.715 ' CE2' HD13 ' A' ' 79' ' ' LEU . 27.1 m-85 -80.96 -23.6 38.67 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.722 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.2 19.64 76.65 Favored Glycine 0 CA--C 1.523 0.574 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.908 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.485 ' O ' HD12 ' A' ' 40' ' ' LEU . 13.1 mt-30 -155.92 148.36 17.74 Favored Pre-proline 0 C--O 1.233 0.217 0 CA-C-N 116.792 0.296 . . . . 0.0 111.005 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.35 104.29 1.83 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.701 2.267 . . . . 0.0 112.325 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.485 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.2 mp -109.23 138.32 45.77 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.059 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -81.22 138.42 35.79 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.064 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.2 mp -90.61 120.66 31.86 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.871 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -108.27 116.76 32.56 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.235 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.535 ' HB2' HD11 ' A' ' 53' ' ' LEU . 17.7 t80 -110.32 120.36 42.17 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.83 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -130.44 135.58 48.14 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.831 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -77.4 -62.55 1.62 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.863 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.85 -53.69 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.366 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -104.5 -32.46 8.97 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.417 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.427 HD13 ' H ' ' A' ' 50' ' ' SER . 0.1 OUTLIER -106.49 137.32 44.69 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.692 0.282 . . . . 0.0 111.236 -179.725 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.427 ' H ' HD13 ' A' ' 49' ' ' LEU . 15.7 m -113.82 130.4 56.47 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.841 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.4 mt -124.01 133.01 70.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.195 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.2 tt -89.68 131.33 35.71 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.821 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.535 HD11 ' HB2' ' A' ' 44' ' ' TYR . 7.3 mt -87.58 103.85 15.95 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.896 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -109.12 -36.55 6.03 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.025 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -128.05 174.48 9.18 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.171 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.401 ' HG2' ' HB2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -62.56 -32.48 73.45 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.074 179.813 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -54.12 -41.54 68.45 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.034 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.518 ' HB3' HD23 ' A' ' 53' ' ' LEU . 7.8 m-20 -63.39 -47.5 81.79 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.012 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.06 -40.16 90.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.89 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.58 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.9 OUTLIER -62.05 -42.97 99.75 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.731 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.57 -33.39 74.92 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.961 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.44 -37.21 84.98 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.275 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.58 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.8 mt -65.77 -43.91 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.645 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.16 -45.36 91.21 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.079 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 26.3 mt -68.26 -41.42 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.091 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.2 tp -68.74 -39.81 80.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.165 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -62.48 -41.89 99.1 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.653 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.6 ptt180 -67.7 -26.99 66.45 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.622 0.249 . . . . 0.0 110.958 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.1 t -70.34 127.33 32.38 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.716 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.1 m -60.82 -37.08 80.77 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.421 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -65.57 0.66 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.196 -179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 9.9 ptt? 37.94 66.36 0.48 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.437 0.46 . . . . 0.0 111.846 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm -110.05 89.32 2.99 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.6 m 63.32 170.34 0.15 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.637 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.8 mp -110.33 122.69 48.29 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.102 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.63 107.44 19.43 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.648 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.9 mt -129.67 131.36 66.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.87 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.1 tp -101.9 126.87 48.89 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.617 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.715 HD13 ' CE2' ' A' ' 36' ' ' PHE . 3.5 mt -93.56 134.38 35.91 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.005 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 pp -150.95 144.09 24.72 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.987 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.2 m -63.02 127.39 31.0 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.124 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -149.18 40.05 0.85 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.816 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -106.72 111.44 23.97 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.855 0.36 . . . . 0.0 111.302 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 64.21 94.93 0.05 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.138 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -98.79 125.94 44.29 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.065 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -135.07 -57.94 0.8 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.789 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.73 168.83 21.09 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.063 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.1 m80 -78.71 125.38 29.3 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.21 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 -82.92 174.88 10.52 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.101 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -135.31 94.09 3.07 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.106 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -130.85 115.56 16.74 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.708 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -105.32 179.74 4.18 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.96 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.049 -0.977 . . . . 0.0 111.39 179.995 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 120.686 0.279 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.4 m -147.08 152.09 37.95 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.262 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 68.81 144.32 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.483 179.721 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.1 t -139.85 123.51 18.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.204 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.2 108.39 19.27 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.571 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.486 HD12 ' CD2' ' A' ' 19' ' ' PHE . 22.8 mt -108.43 125.07 65.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.97 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -95.63 120.36 35.73 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.658 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.661 ' HD2' HD12 ' A' ' 17' ' ' ILE . 61.0 m-85 -113.1 127.41 56.19 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.66 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 14' ' ' ARG . 4.5 pt-20 -123.35 139.86 53.6 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.948 0.404 . . . . 0.0 111.429 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -137.89 114.44 10.41 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.451 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 61.22 38.14 16.89 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.125 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.09 -14.33 59.26 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.332 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.41 105.98 17.95 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 117.073 0.436 . . . . 0.0 110.783 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.403 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -91.44 156.23 17.87 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.073 -179.958 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.1 157.92 43.77 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.046 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.5 mt -114.64 120.29 63.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.661 HD12 ' HD2' ' A' ' 8' ' ' PHE . 11.7 mt -130.71 126.92 61.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.732 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.09 146.51 24.26 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.212 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.486 ' CD2' HD12 ' A' ' 6' ' ' ILE . 29.4 m-85 -138.46 132.84 31.93 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.049 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 p -81.36 165.9 20.93 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.201 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -110.25 143.87 28.95 Favored Pre-proline 0 CA--C 1.529 0.159 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.13 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.52 136.0 41.27 Favored 'Cis proline' 0 C--N 1.35 0.634 0 C-N-CA 123.362 -1.516 . . . . 0.0 112.576 -0.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.0 p -88.77 129.43 39.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.031 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.469 ' O ' HG23 ' A' ' 28' ' ' VAL . 71.2 mmtt -100.49 130.71 46.6 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -54.73 -45.26 74.09 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.113 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -58.76 -42.44 88.91 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.049 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -62.88 -44.26 96.57 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.005 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 24' ' ' LYS . 24.5 t -64.69 -48.24 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.874 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.09 -36.48 81.83 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.014 179.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -58.36 -36.91 74.18 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.13 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.678 ' O ' HG23 ' A' ' 35' ' ' VAL . 3.8 mttt -72.91 -47.92 41.62 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.669 0.271 . . . . 0.0 110.523 179.394 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.73 -45.43 94.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.264 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -61.67 -38.62 88.43 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.444 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -71.4 -44.29 65.19 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.678 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.0 t -60.67 -50.26 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -179.344 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -83.82 -24.78 30.82 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.53 24.81 32.25 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.913 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.619 ' O ' HD12 ' A' ' 40' ' ' LEU . 14.1 pt20 -177.43 147.58 0.67 Allowed Pre-proline 0 N--CA 1.465 0.296 0 CA-C-N 116.638 0.219 . . . . 0.0 110.611 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.83 108.4 2.56 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.397 2.065 . . . . 0.0 112.0 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.68 HD22 ' CD1' ' A' ' 79' ' ' LEU . 5.1 mp -89.79 140.8 29.24 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.088 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -75.83 120.34 21.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.013 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.508 HD23 ' HB3' ' A' ' 79' ' ' LEU . 67.6 mt -86.71 122.9 31.25 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.449 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -112.89 124.4 52.53 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.111 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.441 ' CD2' HD11 ' A' ' 75' ' ' LEU . 11.7 t80 -108.51 129.01 55.3 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.554 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 6.1 mtt -117.44 127.02 53.61 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.726 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -86.56 -51.93 5.86 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.719 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -173.54 -63.12 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.422 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.61 -27.52 11.3 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.489 179.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.13 153.2 26.06 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.901 0.381 . . . . 0.0 111.31 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.4 t -117.22 128.69 55.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.768 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.8 mm -113.85 133.44 59.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.611 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.473 HD23 ' N ' ' A' ' 53' ' ' LEU . 6.8 tt -95.79 130.06 42.83 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.172 -179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.473 ' N ' HD23 ' A' ' 52' ' ' LEU . 1.2 mt -81.95 107.88 15.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.987 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -38.65 4.67 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.408 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -131.67 -179.39 5.35 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.091 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -64.63 -30.19 71.2 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.816 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -57.91 -39.32 77.65 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.583 0.23 . . . . 0.0 110.928 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -68.46 -43.28 77.34 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.832 0.348 . . . . 0.0 110.488 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.56 -44.78 95.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.933 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.23 -41.46 98.43 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.7 mtpm? -66.15 -36.74 83.92 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.217 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.9 -41.48 99.44 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.599 0.238 . . . . 0.0 111.522 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 11.8 mt -66.12 -43.25 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.587 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.9 -42.7 76.41 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.177 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 14.7 mt -66.43 -42.16 89.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.042 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.625 HD22 HD23 ' A' ' 75' ' ' LEU . 15.8 tp -59.78 -44.58 93.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.887 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.54 -35.96 70.99 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.902 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.2 ttt-85 -70.61 -35.12 72.82 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.298 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.5 t -86.49 94.19 9.36 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.718 0.294 . . . . 0.0 111.048 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 91.2 p -58.79 -36.98 75.33 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.145 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.2 p -60.35 -33.68 72.76 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.389 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.0 mtt -85.88 123.7 31.53 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.187 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.91 -33.95 7.78 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.233 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -116.65 156.46 27.02 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.583 0.23 . . . . 0.0 110.962 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.625 HD23 HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -91.88 129.35 37.87 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.662 179.817 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.404 ' N ' HD13 ' A' ' 75' ' ' LEU . 0.0 OUTLIER -97.17 107.82 20.42 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.048 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.574 ' CG1' HD12 ' A' ' 75' ' ' LEU . 2.9 mp -128.08 132.16 68.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.956 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.7 tp -102.51 118.29 36.54 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.912 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.68 ' CD1' HD22 ' A' ' 40' ' ' LEU . 2.7 pp -110.96 135.41 51.52 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.949 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.447 ' C ' HD23 ' A' ' 40' ' ' LEU . 1.1 mp -137.54 148.05 45.64 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.162 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 m -74.98 98.8 3.68 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.696 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -145.19 63.2 1.29 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.817 0.341 . . . . 0.0 110.915 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -108.52 120.42 42.39 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.343 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.46 37.1 2.71 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.603 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -132.56 122.31 24.6 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.143 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 tp -156.79 43.13 0.37 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.91 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -77.63 151.83 34.14 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.124 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -128.68 -54.75 1.23 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.083 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -97.93 30.19 3.14 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.072 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -142.36 113.03 7.33 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.898 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -177.07 -42.4 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.254 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 56.0 t60 76.34 134.83 0.06 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.241 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 15.2 t60 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.42 -0.8 . . . . 0.0 110.891 -179.979 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 120.599 0.238 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.19 169.38 0.22 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.28 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 54.71 85.11 0.06 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.273 -179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.1 t -87.48 127.81 40.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.245 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -98.54 106.87 19.2 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.685 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.531 ' CG2' HD12 ' A' ' 77' ' ' ILE . 4.0 mp -109.19 133.77 53.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.307 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.82 105.13 13.86 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.546 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.747 ' HB3' HD11 ' A' ' 79' ' ' LEU . 45.6 m-85 -93.17 148.52 21.95 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.15 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -135.7 125.08 24.84 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.982 0.42 . . . . 0.0 111.153 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.2 t-160 -142.16 129.45 21.1 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.514 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.45 29.44 19.01 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.29 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 86.79 -14.1 57.17 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 120.875 -0.679 . . . . 0.0 113.304 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -91.67 132.04 36.64 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 117.078 0.439 . . . . 0.0 110.903 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -101.9 147.7 26.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.184 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -137.1 141.28 42.33 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.969 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.8 mt -111.72 120.76 62.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.125 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.5 mt -133.3 132.74 58.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.141 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.31 141.65 33.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.164 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -123.77 134.94 53.57 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.342 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.6 m -87.47 134.85 33.54 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.142 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.51 149.23 74.81 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.968 179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.22 121.99 8.28 Favored 'Cis proline' 0 C--N 1.35 0.651 0 C-N-CA 123.312 -1.537 . . . . 0.0 112.5 -0.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.421 ' O ' HG13 ' A' ' 23' ' ' VAL . 14.0 p -83.04 119.63 32.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.785 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.434 ' O ' HG23 ' A' ' 28' ' ' VAL . 7.0 mmmt -98.74 143.79 28.7 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.946 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -54.63 -41.41 69.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.001 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.84 -44.48 96.9 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.76 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -62.63 -44.2 96.88 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.259 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 24' ' ' LYS . 22.5 t -67.25 -48.4 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.105 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.04 -39.05 77.45 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.811 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -58.92 -45.8 89.49 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.836 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.678 ' O ' HG23 ' A' ' 35' ' ' VAL . 3.7 mmtt -61.11 -47.88 84.26 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.946 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.2 t -59.0 -46.83 91.42 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.725 0.298 . . . . 0.0 110.849 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.513 HG23 ' N ' ' A' ' 39' ' ' PRO . 22.5 m -61.54 -40.16 93.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.287 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 58.9 m -71.73 -46.22 59.28 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.678 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.1 t -62.79 -50.1 81.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 121.224 -0.19 . . . . 0.0 111.495 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.545 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 85.6 m-85 -83.86 -19.39 34.94 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.306 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.88 -20.42 49.95 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.958 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.501 ' O ' HD12 ' A' ' 40' ' ' LEU . 18.0 mt-30 -134.81 147.36 62.65 Favored Pre-proline 0 N--CA 1.462 0.141 0 CA-C-N 116.816 0.308 . . . . 0.0 110.387 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.513 ' N ' HG23 ' A' ' 33' ' ' THR . 57.6 Cg_endo -72.79 99.25 1.05 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.395 2.063 . . . . 0.0 112.269 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.501 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.2 mp -87.82 156.8 19.22 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.026 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -91.12 140.28 29.97 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.975 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.64 107.47 19.23 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.99 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 113.9 27.7 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.994 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.414 ' CD2' HG12 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -91.68 129.15 37.7 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.219 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -125.35 118.23 25.46 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.951 0.405 . . . . 0.0 110.707 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -88.86 -71.47 0.59 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.049 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -136.19 -72.11 0.45 Allowed 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.37 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -120.9 19.44 11.72 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.127 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.72 147.46 52.51 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.766 0.317 . . . . 0.0 111.134 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.0 p -119.17 126.66 52.09 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.58 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mp -113.62 131.53 65.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.626 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -107.29 121.36 44.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.255 -179.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.6 mt -77.3 95.53 4.38 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.565 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.08 -34.85 11.57 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.134 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -138.24 173.18 11.89 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.847 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -59.26 -34.71 72.57 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.219 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -53.88 -41.14 67.22 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.916 0.389 . . . . 0.0 110.736 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -39.77 94.87 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.011 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 tp -65.35 -43.27 91.39 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.886 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.85 -41.55 97.97 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.797 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -65.21 -36.73 85.1 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.957 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.47 -39.17 92.55 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.499 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 25.4 mt -64.23 -43.18 97.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.751 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.43 -39.27 70.05 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.187 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.8 mt -67.32 -44.62 87.16 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.133 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.572 HD13 ' HG ' ' A' ' 75' ' ' LEU . 1.0 OUTLIER -59.63 -47.24 86.38 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.537 -0.302 . . . . 0.0 110.683 179.933 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -64.26 -37.39 87.31 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.7 -33.03 74.95 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.2 179.637 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.1 t -67.02 136.24 54.97 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.83 0.348 . . . . 0.0 111.252 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 18.2 m -74.77 -25.75 59.28 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.501 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.1 t -134.4 82.35 1.96 Allowed 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.06 0.457 . . . . 0.0 110.578 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 30.7 tpp -158.25 105.44 1.91 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.596 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -102.82 -63.15 1.19 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.028 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.8 t -82.0 158.17 23.94 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.181 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.572 ' HG ' HD13 ' A' ' 66' ' ' LEU . 7.2 mp -101.15 125.22 47.76 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.102 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 107.38 19.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.662 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.531 HD12 ' CG2' ' A' ' 6' ' ' ILE . 22.1 mt -129.44 131.77 67.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.829 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.82 132.32 47.65 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.636 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.747 HD11 ' HB3' ' A' ' 8' ' ' PHE . 10.0 mt -93.66 128.81 40.02 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.174 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.9 mt -133.96 136.24 44.04 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.48 103.08 2.36 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.767 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -123.68 46.08 2.31 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.121 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -98.08 116.05 29.5 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.772 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.52 32.26 2.54 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.483 179.513 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -163.44 179.26 7.43 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.679 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 mp -115.25 -63.94 1.39 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.927 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -117.83 -46.79 2.63 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.803 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -148.57 138.74 22.43 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.151 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -163.2 -60.97 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.043 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 38.0 t60 -122.45 -61.32 1.48 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.81 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -91.86 143.32 26.63 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.017 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -166.67 87.58 0.32 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.95 0.405 . . . . 0.0 111.379 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 118.488 -0.768 . . . . 0.0 110.656 179.665 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.819 0.343 . . . . 0.0 111.269 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.7 p -147.33 177.48 9.18 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.192 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 66.46 102.13 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.419 0.449 . . . . 0.0 110.974 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.8 t -97.78 135.96 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.328 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.0 114.37 23.55 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.113 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.53 ' CG2' HD12 ' A' ' 77' ' ' ILE . 31.0 mm -109.06 119.75 59.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.901 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.41 114.46 26.23 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.746 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PHE . . . . . 0.473 ' CD2' HD12 ' A' ' 17' ' ' ILE . 51.8 m-85 -100.37 140.32 34.79 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.184 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.72 124.74 20.03 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.124 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -138.89 112.04 7.99 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.575 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 58.46 36.3 25.24 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.353 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.69 -14.27 61.98 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.886 -0.674 . . . . 0.0 113.096 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.8 104.55 11.39 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.957 0.379 . . . . 0.0 110.622 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptp85 -92.3 136.85 32.86 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.189 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.434 ' HD3' HD11 ' A' ' 17' ' ' ILE . 16.0 ttt85 -137.06 143.53 42.68 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.162 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.93 120.71 61.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.864 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.473 HD12 ' CD2' ' A' ' 8' ' ' PHE . 27.8 mt -134.72 132.55 54.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.168 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.59 143.83 25.94 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.128 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.506 ' CE2' HG22 ' A' ' 28' ' ' VAL . 6.9 m-85 -129.99 121.14 25.94 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.282 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -76.11 129.41 36.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.838 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -70.25 150.73 95.94 Favored Pre-proline 0 N--CA 1.463 0.212 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.086 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -75.24 134.13 34.52 Favored 'Cis proline' 0 C--N 1.35 0.651 0 C-N-CA 123.705 -1.373 . . . . 0.0 112.472 0.116 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.419 ' O ' HG13 ' A' ' 23' ' ' VAL . 11.6 p -84.12 118.32 31.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-O 120.944 0.402 . . . . 0.0 110.792 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 28' ' ' VAL . 20.3 mmtm -101.1 129.94 47.07 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.862 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.631 ' CE1' HD12 ' A' ' 42' ' ' LEU . 54.0 t80 -55.55 -45.16 77.28 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.952 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -60.1 -42.32 94.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.053 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.49 -44.07 97.27 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.036 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.562 ' O ' HG23 ' A' ' 32' ' ' VAL . 23.3 t -66.75 -48.0 81.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.577 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.8 -41.59 87.12 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.207 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -57.31 -45.36 84.28 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.877 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.74 ' O ' HG23 ' A' ' 35' ' ' VAL . 3.4 tttm -66.54 -47.83 71.65 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.691 -0.232 . . . . 0.0 110.989 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 28' ' ' VAL . 45.8 t -58.34 -43.67 86.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.711 0.291 . . . . 0.0 110.982 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 97.2 m -62.84 -38.92 92.7 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.905 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.6 m -71.68 -45.61 61.39 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.384 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.74 HG23 ' O ' ' A' ' 31' ' ' LYS . 40.9 t -58.88 -49.69 82.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 120.524 0.202 . . . . 0.0 111.509 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -83.4 -26.91 29.99 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.76 25.54 32.1 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.954 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.556 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -169.97 145.67 2.48 Favored Pre-proline 0 N--CA 1.464 0.265 0 CA-C-N 116.871 0.335 . . . . 0.0 110.96 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.52 103.52 1.56 Allowed 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.586 2.191 . . . . 0.0 112.394 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.556 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.9 mp -96.26 154.92 16.99 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.107 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -88.72 140.97 28.9 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.997 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.631 HD12 ' CE1' ' A' ' 25' ' ' TYR . 67.5 mt -100.71 124.05 45.78 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.606 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.486 ' ND1' HD21 ' A' ' 80' ' ' LEU . 6.3 m80 -117.0 129.32 55.95 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.162 -179.521 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.404 ' CD2' ' HB1' ' A' ' 62' ' ' ALA . 19.2 t80 -114.32 129.69 56.65 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.763 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.4 mtm -111.31 113.36 25.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.542 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.9 p-10 -67.17 -52.59 39.46 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.282 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -148.84 -73.9 0.18 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.331 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -119.67 14.13 12.58 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.336 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.48 148.72 52.66 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.66 0.267 . . . . 0.0 111.164 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.4 m -112.21 128.76 56.34 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.112 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.7 mp -115.96 132.1 66.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.925 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -81.88 134.31 35.39 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.706 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp -102.65 104.03 14.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.059 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.43 -35.92 6.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.358 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -120.17 170.83 8.95 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.771 0.319 . . . . 0.0 111.051 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.48 -35.51 77.87 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.03 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -55.07 -41.16 71.16 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.069 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -64.03 -47.25 80.97 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.68 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.487 HD13 ' HD1' ' A' ' 25' ' ' TYR . 5.0 tp -63.17 -41.88 99.3 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.149 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -43.07 99.81 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.01 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -34.07 77.23 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.132 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.404 ' HB1' ' CD2' ' A' ' 44' ' ' TYR . . . -62.57 -35.34 79.19 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.275 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.598 ' CD1' HD11 ' A' ' 75' ' ' LEU . 29.8 mm -64.24 -44.56 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.627 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -40.88 71.82 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.118 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 37.1 mm -63.34 -45.14 98.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.912 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 tp -62.8 -44.66 95.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.719 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -64.32 -34.7 78.75 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.274 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -32.13 71.73 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.054 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -70.9 154.15 42.07 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.047 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.3 p -76.22 -33.66 59.23 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.362 179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.7 p -70.66 -76.01 0.11 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.525 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.2 ttt 53.33 82.8 0.07 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.849 0.357 . . . . 0.0 111.217 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.85 -39.69 3.24 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.94 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.3 t -155.76 162.67 40.47 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.533 0.206 . . . . 0.0 110.946 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.598 HD11 ' CD1' ' A' ' 63' ' ' ILE . 0.3 OUTLIER -94.43 128.22 40.84 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.088 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.84 109.6 20.93 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.97 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.53 HD12 ' CG2' ' A' ' 6' ' ' ILE . 32.7 mt -128.79 128.64 67.84 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.925 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.99 131.3 48.49 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.741 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.425 HD23 ' CD2' ' A' ' 42' ' ' LEU . 2.3 mt -100.56 133.05 45.58 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.039 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.486 HD21 ' ND1' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -156.57 135.71 12.01 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.83 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.06 101.46 1.14 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.88 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -155.74 65.63 0.6 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.649 -179.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -163.78 81.69 0.44 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.997 0.427 . . . . 0.0 111.076 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.75 -41.93 3.02 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.174 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -147.09 178.5 8.32 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.106 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.23 161.98 13.58 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.751 0.31 . . . . 0.0 111.275 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -77.71 162.93 26.61 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.282 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -98.75 175.81 5.84 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.36 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.445 ' O ' ' HB2' ' A' ' 90' ' ' HIS . 22.2 m-70 -96.46 172.56 7.86 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.195 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.445 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 2.4 m-70 69.41 103.47 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.284 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -67.67 173.42 4.27 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.024 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.98 33.81 9.45 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.736 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.087 -0.959 . . . . 0.0 111.262 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 . . . . . 0 C--O 1.233 0.217 0 CA-C-O 121.051 0.453 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.0 t -82.07 134.81 26.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.799 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.2 ttm105 -97.97 113.01 24.73 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.531 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.534 HG23 ' HB2' ' A' ' 75' ' ' LEU . 4.0 mp -114.61 134.09 58.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.185 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -104.33 114.66 29.04 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.878 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.689 ' CD2' HD12 ' A' ' 17' ' ' ILE . 79.4 m-85 -102.52 143.45 32.2 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.153 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.422 ' HG3' ' HG3' ' A' ' 14' ' ' ARG . 36.7 tt0 -133.01 129.51 38.25 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.344 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -139.24 115.1 10.12 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.518 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.02 34.28 23.44 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.234 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.44 -14.24 61.71 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 120.995 -0.622 . . . . 0.0 113.253 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -85.06 119.43 25.44 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.996 0.398 . . . . 0.0 110.641 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.422 ' HG3' ' HG3' ' A' ' 9' ' ' GLU . 2.7 mpt_? -100.05 149.01 23.92 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.195 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.4 mtp-105 -144.41 143.73 31.06 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.32 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mt -103.01 118.85 50.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.842 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.689 HD12 ' CD2' ' A' ' 8' ' ' PHE . 34.1 mt -128.97 135.92 60.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-O 120.77 0.319 . . . . 0.0 111.24 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.15 140.92 37.59 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.337 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.552 ' CE2' HG13 ' A' ' 28' ' ' VAL . 8.5 m-85 -128.3 119.77 25.75 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.026 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.2 t -73.61 125.77 28.78 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.017 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -63.15 148.21 93.31 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.237 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.19 134.01 33.4 Favored 'Cis proline' 0 C--N 1.35 0.612 0 C-N-CA 123.33 -1.529 . . . . 0.0 112.61 0.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 23' ' ' VAL . 11.6 p -79.58 114.28 20.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 121.014 0.435 . . . . 0.0 110.948 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.477 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.6 OUTLIER -102.53 140.64 36.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.197 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -59.15 -38.47 79.76 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.929 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.44 -45.06 95.03 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.637 0.256 . . . . 0.0 111.099 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.29 -42.33 88.53 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.179 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.587 ' O ' HG23 ' A' ' 32' ' ' VAL . 40.8 t -70.33 -48.99 57.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.07 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.75 -44.53 96.72 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.444 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -58.52 -39.0 78.92 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.559 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.744 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -67.05 -47.61 70.81 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.761 179.537 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 28' ' ' VAL . 26.3 t -62.51 -44.34 99.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.149 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.8 m -62.43 -39.1 92.22 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.23 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.0 m -71.68 -45.08 63.02 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 121.253 -0.179 . . . . 0.0 111.467 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.744 HG23 ' O ' ' A' ' 31' ' ' LYS . 50.8 t -60.14 -50.19 81.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.492 0.187 . . . . 0.0 111.373 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.461 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 25.0 m-85 -82.33 -25.24 34.07 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.05 22.05 69.44 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.996 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -152.63 152.0 27.92 Favored Pre-proline 0 N--CA 1.463 0.217 0 CA-C-N 116.949 0.374 . . . . 0.0 110.997 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.64 85.0 1.16 Allowed 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.599 2.2 . . . . 0.0 112.131 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.7 mp -85.83 145.09 27.36 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.225 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -97.78 139.73 33.22 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.952 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.8 mt -98.54 127.83 44.63 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.981 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -115.31 116.29 28.05 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.082 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -91.87 108.15 19.72 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.894 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -104.99 117.5 34.16 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.476 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -76.32 -59.97 2.54 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.785 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -178.38 -51.04 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.265 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -103.58 -31.98 9.66 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.522 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.5 tp -119.8 156.4 30.7 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.805 0.336 . . . . 0.0 111.637 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.9 t -116.74 131.28 56.99 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.136 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.9 mm -114.29 133.84 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.977 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.517 HD22 ' HG2' ' A' ' 54' ' ' LYS . 5.7 tt -96.55 135.19 38.79 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.768 0.318 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.459 HD23 ' HB2' ' A' ' 58' ' ' ASP . 3.0 mt -87.83 102.1 14.36 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.176 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.517 ' HG2' HD22 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -106.35 -35.17 7.22 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.349 179.74 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 22.9 p30 -142.8 -179.94 6.63 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.314 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -61.2 -33.62 73.76 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.814 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -53.06 -42.82 66.17 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.951 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.459 ' HB2' HD23 ' A' ' 53' ' ' LEU . 61.7 m-20 -65.28 -44.59 87.54 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.903 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.508 ' HG ' HD11 ' A' ' 63' ' ' ILE . 12.7 tp -67.81 -40.15 83.87 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.09 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.21 -43.25 99.18 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.781 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -64.48 -44.0 92.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.416 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.23 -45.67 92.31 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.864 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.508 HD11 ' HG ' ' A' ' 59' ' ' LEU . 15.0 mt -66.47 -42.16 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 120.556 0.217 . . . . 0.0 110.925 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -56.76 -45.63 81.95 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.244 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 15.9 mt -70.28 -41.24 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.235 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.25 -46.85 88.67 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.952 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.3 -38.43 89.35 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.733 0.302 . . . . 0.0 110.83 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 mmm180 -62.43 -33.75 75.42 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.281 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.9 t -87.69 103.12 15.3 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.978 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 85.5 p -61.78 -31.95 72.19 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.288 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.7 m -60.32 -42.74 96.24 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.924 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mtt -68.61 151.41 46.77 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.119 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -135.83 -64.74 0.61 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.212 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.36 173.0 8.99 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.023 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.534 ' HB2' HG23 ' A' ' 6' ' ' ILE . 6.9 mp -112.97 125.82 54.81 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.103 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 mtt-85 -92.57 107.49 19.25 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.711 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.4 mt -129.59 132.25 66.37 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.868 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.3 tp -102.08 127.38 49.0 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.71 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 8' ' ' PHE . 1.6 mt -93.67 127.71 39.5 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.099 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mp -132.5 142.97 49.44 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.867 0.365 . . . . 0.0 111.375 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.463 0.21 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.968 179.879 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.766 0.317 . . . . 0.0 110.818 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.513 HG23 ' HG3' ' A' ' 21' ' ' ARG . 39.5 t -71.82 131.05 35.11 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.107 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.451 ' NE ' HG21 ' A' ' 16' ' ' ILE . 5.7 ttt180 -86.65 110.45 19.86 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.96 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 21.7 mt -113.56 129.46 69.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.95 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -100.85 123.26 44.78 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.812 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.602 ' CD2' HD12 ' A' ' 17' ' ' ILE . 99.1 m-85 -115.54 133.46 56.02 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.009 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -134.1 127.63 32.52 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.909 0.385 . . . . 0.0 111.326 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -148.43 131.19 16.02 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.59 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 60.51 29.54 19.09 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.266 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.29 -13.86 59.0 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.857 -0.687 . . . . 0.0 113.288 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -83.22 107.74 15.97 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 117.056 0.428 . . . . 0.0 110.942 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.0 ptt180 -97.27 135.99 38.4 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.108 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 -149.75 155.47 40.2 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.3 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.451 HG21 ' NE ' ' A' ' 5' ' ' ARG . 4.3 mt -117.83 120.09 63.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.848 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.602 HD12 ' CD2' ' A' ' 8' ' ' PHE . 22.9 mt -117.39 132.14 68.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.252 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.67 137.07 38.65 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.092 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -128.85 125.88 38.62 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.044 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 78.3 p -67.75 139.37 56.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.177 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.513 ' HG3' HG23 ' A' ' 4' ' ' VAL . 11.4 mtm180 -88.9 149.67 43.99 Favored Pre-proline 0 C--O 1.234 0.241 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.144 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -74.63 122.34 8.0 Favored 'Cis proline' 0 C--N 1.351 0.669 0 C-N-CA 123.64 -1.4 . . . . 0.0 112.498 0.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.41 ' N ' ' HA ' ' A' ' 21' ' ' ARG . 12.3 p -70.59 125.36 28.72 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.755 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 28' ' ' VAL . 3.9 mttp -95.88 130.37 42.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -56.17 -38.41 70.88 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.741 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.86 -44.36 94.18 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.826 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.46 -41.62 88.77 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.252 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 24' ' ' LYS . 39.3 t -68.03 -48.99 72.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.971 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.26 -43.08 92.47 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.848 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 -42.18 80.73 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.911 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.74 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -63.43 -48.1 79.19 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.222 179.601 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.0 t -62.6 -42.47 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.287 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.5 m -63.93 -39.06 93.3 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.044 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 35.0 m -71.51 -47.15 57.15 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.74 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.3 t -58.54 -49.46 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 120.52 0.2 . . . . 0.0 111.506 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.476 ' CE2' HD13 ' A' ' 79' ' ' LEU . 25.4 m-85 -83.6 -24.66 31.38 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.85 26.29 67.35 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.98 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -157.78 155.94 27.62 Favored Pre-proline 0 C--O 1.233 0.189 0 CA-C-N 116.864 0.332 . . . . 0.0 111.173 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.94 95.65 0.91 Allowed 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.657 2.238 . . . . 0.0 112.165 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mp -100.32 148.6 24.5 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.068 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -100.47 139.78 35.66 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.996 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.452 HD22 HG21 ' A' ' 77' ' ' ILE . 35.6 mt -87.68 106.3 17.95 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.662 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -100.53 114.93 28.96 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.017 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.471 ' CZ ' ' HB1' ' A' ' 62' ' ' ALA . 1.1 t80 -93.46 126.9 38.85 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.168 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -128.26 116.83 20.46 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.812 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -77.5 -49.18 15.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.436 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -172.83 -62.93 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.476 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.65 -23.64 11.35 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.771 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.35 141.07 36.57 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.839 0.352 . . . . 0.0 111.581 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.59 128.16 55.54 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.964 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.2 mt -122.16 133.08 69.57 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.758 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.5 tt -95.07 135.32 36.75 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 mt -97.15 108.79 21.59 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.94 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -107.84 -40.94 5.12 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.221 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.1 p-10 -129.93 179.65 5.74 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.474 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -61.63 -30.92 71.02 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.185 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.25 -46.72 72.66 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.057 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -68.61 -37.52 79.83 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.847 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 tp -66.9 -43.7 82.72 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.805 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -66.53 -37.42 84.98 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.154 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -37.01 84.39 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.762 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.471 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -65.37 -43.64 90.15 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.081 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.635 HD13 HD21 ' A' ' 75' ' ' LEU . 39.4 mm -64.12 -43.25 97.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.143 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -53.82 -46.02 71.0 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.859 0.361 . . . . 0.0 110.848 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.6 mt -64.53 -39.43 85.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.966 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tp -65.23 -46.73 79.43 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.188 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.42 ' OD2' HG22 ' A' ' 63' ' ' ILE . 10.9 m-20 -61.27 -36.61 80.49 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.686 0.279 . . . . 0.0 111.061 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.9 mtt-85 -60.39 -33.53 72.61 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.421 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.6 p -80.32 132.97 35.89 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.728 0.299 . . . . 0.0 111.168 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.2 p -76.21 -33.87 59.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.681 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.2 p -97.31 38.13 1.28 Allowed 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.82 142.78 44.6 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.808 0.337 . . . . 0.0 111.508 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.96 73.37 1.48 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.848 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.7 t 60.64 -169.05 0.16 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.488 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.635 HD21 HD13 ' A' ' 63' ' ' ILE . 2.2 mp -111.01 133.4 53.43 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.024 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.4 mtt85 -101.61 107.49 18.76 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.835 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.452 HG21 HD22 ' A' ' 42' ' ' LEU . 29.9 mt -129.47 132.13 66.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.499 HD23 HD11 ' A' ' 80' ' ' LEU . 0.9 OUTLIER -101.98 120.58 40.64 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.668 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 8' ' ' PHE . 1.8 mt -95.76 124.85 39.97 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.95 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.499 HD11 HD23 ' A' ' 78' ' ' LEU . 11.3 mt -137.41 147.71 45.63 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.006 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.463 0.176 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.074 -179.969 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.233 0.194 0 CA-C-O 120.517 0.199 . . . . 0.0 110.466 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 24.2 t -70.23 126.55 30.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.608 0.242 . . . . 0.0 110.604 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -86.89 112.75 22.07 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.047 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.435 HD12 ' HD2' ' A' ' 19' ' ' PHE . 4.9 mt -113.23 136.02 50.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.901 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -97.63 127.79 43.85 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.829 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -108.89 134.74 51.16 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.997 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.24 125.87 50.16 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.263 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -149.2 123.4 9.53 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.556 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 57.99 35.52 25.33 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 120.93 0.395 . . . . 0.0 110.878 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.19 12.76 76.29 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.126 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -100.98 145.77 28.26 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.934 0.367 . . . . 0.0 110.96 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -97.79 142.74 29.18 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.217 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.403 ' NH2' HG11 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -144.29 136.91 26.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.188 179.858 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.4 mm -115.16 112.38 39.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.865 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 24.3 mm -129.56 125.98 62.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.928 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.74 146.47 26.5 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.307 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.435 ' HD2' HD12 ' A' ' 6' ' ' ILE . 46.5 m-85 -131.26 120.95 23.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.836 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.4 p -68.08 145.41 54.45 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.968 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 mtt85 -87.55 143.17 33.59 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.086 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -77.52 144.32 76.89 Favored 'Cis proline' 0 C--N 1.349 0.602 0 C-N-CA 123.337 -1.526 . . . . 0.0 112.81 0.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.1 p -99.24 130.44 48.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.989 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.461 ' O ' HG23 ' A' ' 28' ' ' VAL . 7.4 mmtt -102.27 133.19 47.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.805 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.43 ' HE1' HD12 ' A' ' 42' ' ' LEU . 75.8 t80 -57.88 -38.51 75.89 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.927 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.81 -44.11 97.29 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.994 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.94 -44.29 96.48 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.125 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.773 ' O ' HG23 ' A' ' 32' ' ' VAL . 23.9 t -61.29 -48.14 90.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.788 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.19 -43.97 89.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.229 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -57.73 -47.05 83.54 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.988 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.637 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -61.05 -44.7 96.99 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.861 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 28' ' ' VAL . 38.5 t -61.24 -42.7 94.48 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.914 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.4 m -61.66 -39.5 91.61 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.969 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.6 m -71.58 -47.96 51.4 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.755 -0.202 . . . . 0.0 111.373 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 31' ' ' LYS . 42.7 t -61.84 -50.16 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-O 120.62 0.248 . . . . 0.0 111.245 -179.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -78.25 -24.13 47.02 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.649 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.61 19.17 74.13 Favored Glycine 0 CA--C 1.525 0.662 0 C-N-CA 121.07 -0.585 . . . . 0.0 113.166 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -168.4 154.31 6.76 Favored Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 116.867 0.334 . . . . 0.0 110.74 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.78 143.62 46.43 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.584 2.189 . . . . 0.0 112.387 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.658 HD13 HG12 ' A' ' 32' ' ' VAL . 1.1 mp -138.07 163.34 31.85 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.072 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.6 125.88 51.16 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.446 HD23 ' HB3' ' A' ' 79' ' ' LEU . 75.2 mt -84.29 113.33 21.05 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.035 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 121.65 44.62 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.193 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.476 ' CE2' ' HB1' ' A' ' 62' ' ' ALA . 21.0 t80 -108.31 116.67 32.39 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.365 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.3 mtt -104.3 133.67 48.81 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.984 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -90.8 -51.13 5.52 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.742 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -171.41 -62.47 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.531 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -107.98 -29.15 9.17 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.43 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.21 160.22 16.0 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.914 0.388 . . . . 0.0 111.32 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.44 132.38 56.24 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.901 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.8 mt -113.65 134.38 56.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.83 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.08 126.73 35.26 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.182 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 44' ' ' TYR . 5.7 mt -88.16 86.48 7.1 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.648 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -106.0 -33.0 8.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.292 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -117.11 158.61 23.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.726 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -59.9 -35.01 73.95 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.711 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.14 -39.96 70.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.117 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -60.75 -45.51 94.03 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.91 0.386 . . . . 0.0 110.793 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 tp -71.04 -38.31 72.54 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.001 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.61 -43.15 90.5 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.108 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -34.37 77.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.954 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.476 ' HB1' ' CE2' ' A' ' 44' ' ' TYR . . . -62.36 -39.77 94.23 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.299 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.4 mm -66.48 -42.88 90.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.595 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -59.03 -45.36 90.93 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.984 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.5 mt -65.75 -44.44 93.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.026 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.5 tp -63.67 -37.96 89.3 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.173 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -57.47 -38.15 74.05 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.995 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.98 -31.56 69.33 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.036 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.9 t -66.69 138.24 57.27 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.802 0.334 . . . . 0.0 111.355 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.9 m -75.55 -35.15 60.73 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.43 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 53.2 p -96.39 37.41 1.26 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.45 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.94 105.45 0.57 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.776 0.322 . . . . 0.0 110.775 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.46 86.9 2.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.588 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 p 55.33 -173.8 0.05 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.416 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 75' ' ' LEU . 3.7 mm? -112.75 130.22 56.14 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -92.99 107.76 19.47 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.916 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.5 mt -129.54 131.18 67.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.763 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.76 118.8 37.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.42 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.446 ' HB3' HD23 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -119.95 129.58 54.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.006 -179.723 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.72 147.39 32.93 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.644 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.464 0.234 0 CA-C-O 121.05 0.452 . . . . 0.0 110.808 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 . . . . . 0 N--CA 1.465 0.312 0 CA-C-O 120.88 0.371 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.6 t -107.37 117.74 53.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.996 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.23 105.15 17.02 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.501 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.5 mt -100.5 116.89 44.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.245 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -109.03 113.73 26.85 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.643 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.63 ' HB2' HD11 ' A' ' 79' ' ' LEU . 24.3 p90 -117.34 146.13 43.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.244 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -128.34 144.46 51.13 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.354 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -143.37 113.05 6.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.491 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 m120 57.6 39.28 27.73 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.233 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.56 -14.09 60.68 Favored Glycine 0 CA--C 1.524 0.616 0 C-N-CA 120.997 -0.62 . . . . 0.0 113.346 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -86.33 103.69 15.15 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 117.066 0.433 . . . . 0.0 110.636 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.98 140.44 29.65 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.273 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.5 mtt85 -134.72 138.59 44.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.99 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mt -117.48 123.38 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.134 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.7 mt -136.18 132.82 49.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.199 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.74 136.25 42.91 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.036 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.479 ' CE2' HG13 ' A' ' 28' ' ' VAL . 83.8 m-85 -124.84 125.56 44.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.792 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -71.5 124.93 25.75 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -73.0 146.39 87.4 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.056 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -74.79 129.19 17.89 Favored 'Cis proline' 0 C--N 1.349 0.568 0 C-N-CA 123.697 -1.376 . . . . 0.0 112.543 -0.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.2 p -96.55 130.58 44.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.249 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.428 ' O ' HG23 ' A' ' 28' ' ' VAL . 9.8 mmtm -89.56 139.84 30.14 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.029 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -59.22 -44.91 92.28 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.04 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.35 -38.86 78.06 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.954 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -65.23 -44.45 88.22 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.033 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.479 HG13 ' CE2' ' A' ' 19' ' ' PHE . 23.2 t -68.19 -49.26 68.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.871 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -59.28 -41.67 89.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.176 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -57.73 -41.68 82.32 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.983 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.754 ' O ' HG23 ' A' ' 35' ' ' VAL . 6.6 tttt -63.29 -48.07 79.65 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.42 -42.14 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.135 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.4 m -65.44 -39.05 91.61 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.228 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.6 m -71.35 -44.71 64.52 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.895 -0.139 . . . . 0.0 111.337 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.754 HG23 ' O ' ' A' ' 31' ' ' LYS . 54.3 t -60.33 -50.02 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.509 0.195 . . . . 0.0 111.214 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.62 ' CE2' HD13 ' A' ' 79' ' ' LEU . 25.7 m-85 -80.17 -26.37 39.33 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.742 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.88 26.75 55.32 Favored Glycine 0 CA--C 1.522 0.475 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.823 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.541 ' O ' HD12 ' A' ' 40' ' ' LEU . 5.5 pt20 -167.21 156.21 9.3 Favored Pre-proline 0 N--CA 1.462 0.169 0 CA-C-N 116.764 0.282 . . . . 0.0 111.0 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.38 109.39 2.83 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.575 2.183 . . . . 0.0 112.279 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.551 HD23 ' HB3' ' A' ' 79' ' ' LEU . 5.6 mp -107.84 134.84 50.2 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.926 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -84.91 133.07 34.3 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.736 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.43 ' HB3' HG21 ' A' ' 77' ' ' ILE . 2.4 mp -92.31 108.81 20.23 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.873 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -104.9 118.93 37.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.22 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.426 ' OH ' HD12 ' A' ' 75' ' ' LEU . 1.1 t80 -91.04 128.89 37.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.81 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.8 ptm -128.42 114.5 16.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.801 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -85.36 -54.15 4.77 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.546 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -167.12 -64.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.401 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -109.5 -23.71 11.36 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.748 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 tt -111.91 146.92 36.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 120.86 0.362 . . . . 0.0 111.305 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 m -120.52 132.78 55.35 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.896 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mp -116.19 133.8 61.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.658 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 tt -98.12 126.56 43.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.831 0.348 . . . . 0.0 110.86 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.8 mt -70.89 97.89 1.49 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.109 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.29 -38.13 11.67 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.182 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -152.61 -173.69 4.65 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.32 -30.79 69.74 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.267 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -53.21 -50.39 64.79 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.081 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.36 -43.5 98.68 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.986 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.51 -38.05 89.65 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.845 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.866 ' HA ' HD12 ' A' ' 63' ' ' ILE . 1.1 t0 -61.39 -43.48 98.79 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.731 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -35.53 81.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.908 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.579 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.58 -35.32 80.12 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.249 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.866 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -64.67 -42.76 95.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.748 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.16 -39.56 63.68 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.031 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.579 HD12 ' HA ' ' A' ' 62' ' ' ALA . 13.8 mt -66.32 -39.46 84.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.847 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.809 HD13 HD13 ' A' ' 75' ' ' LEU . 9.3 tp -62.71 -42.85 99.86 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.986 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -64.02 -34.4 77.91 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.336 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 50.8 ttt85 -75.43 -34.05 60.97 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.098 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.6 t -85.74 129.41 34.84 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.344 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.46 -40.49 29.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.015 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -75.36 -41.78 55.7 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.34 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.49 101.3 0.17 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.799 0.333 . . . . 0.0 111.062 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.13 -37.48 11.57 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.933 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -121.55 175.24 6.31 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.723 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.809 HD13 HD13 ' A' ' 66' ' ' LEU . 1.4 mm? -101.99 129.78 48.36 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.694 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -86.75 108.79 18.85 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.007 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.43 HG21 ' HB3' ' A' ' 42' ' ' LEU . 2.9 mt -124.81 132.08 71.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.095 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 tp -102.17 122.67 44.62 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.483 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.63 HD11 ' HB2' ' A' ' 8' ' ' PHE . 4.6 mt -96.18 135.98 37.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.085 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.04 135.89 14.54 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.984 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.3 p . . . . . 0 C--O 1.233 0.232 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.98 179.968 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 . . . . . 0 N--CA 1.464 0.267 0 CA-C-O 120.847 0.356 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -144.81 132.7 16.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.036 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.81 111.28 20.6 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.512 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.484 HD12 ' CD1' ' A' ' 19' ' ' PHE . 27.7 mt -107.56 118.4 55.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.934 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -96.59 123.01 40.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.933 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.588 ' HB3' HD11 ' A' ' 79' ' ' LEU . 29.4 m-85 -115.73 127.15 54.91 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -122.13 132.62 54.56 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.829 0.347 . . . . 0.0 111.043 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.411 ' HB2' HD12 ' A' ' 79' ' ' LEU . 11.1 t-160 -146.04 117.2 7.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.652 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.52 33.22 22.09 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.21 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.71 -14.0 62.72 Favored Glycine 0 CA--C 1.525 0.658 0 C-N-CA 120.937 -0.649 . . . . 0.0 113.077 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -88.04 110.72 20.84 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.941 0.37 . . . . 0.0 110.887 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.66 144.3 28.9 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.201 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.1 mtt85 -133.49 149.81 51.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.993 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.523 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.7 mp -115.82 112.76 41.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.803 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.527 HD12 ' N ' ' A' ' 17' ' ' ILE . 3.5 mp -123.53 136.91 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 120.861 0.362 . . . . 0.0 111.319 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.13 129.5 42.21 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.027 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.484 ' CD1' HD12 ' A' ' 6' ' ' ILE . 21.4 m-85 -124.76 126.39 45.58 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.967 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 p -66.48 135.74 54.68 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.161 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -100.54 146.31 31.81 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.042 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.21 123.49 9.42 Favored 'Cis proline' 0 C--N 1.35 0.655 0 C-N-CA 123.335 -1.527 . . . . 0.0 112.499 -0.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.54 130.03 36.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.975 0.417 . . . . 0.0 111.254 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.562 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -89.54 146.39 24.62 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.044 -179.859 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -56.98 -37.27 71.38 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.083 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -61.32 -43.72 98.4 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.919 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.76 -39.18 87.77 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.142 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 24' ' ' LYS . 18.7 t -67.96 -48.85 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.872 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.46 ' O ' HG22 ' A' ' 33' ' ' THR . 0.2 OUTLIER -58.7 -44.68 90.38 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.926 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.433 ' HA ' HG22 ' A' ' 33' ' ' THR . 2.0 m80 -59.99 -37.03 78.48 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.126 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.692 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -70.94 -48.06 55.59 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.857 179.642 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 28' ' ' VAL . 31.2 t -65.5 -45.75 91.81 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.431 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.46 HG22 ' O ' ' A' ' 29' ' ' GLU . 14.7 t -61.0 -38.93 87.78 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.708 -179.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.6 m -71.24 -43.78 66.62 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.2 t -64.89 -50.53 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 120.576 0.227 . . . . 0.0 111.419 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.565 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 92.1 m-85 -83.72 -13.34 54.23 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.26 24.03 71.86 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.88 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -153.15 147.31 18.75 Favored Pre-proline 0 CA--C 1.529 0.172 0 CA-C-N 116.752 0.276 . . . . 0.0 110.961 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.24 71.73 5.05 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.559 2.173 . . . . 0.0 112.124 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.4 mp -76.92 131.55 38.61 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.847 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -76.98 140.09 40.3 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.991 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.54 HD22 HG21 ' A' ' 77' ' ' ILE . 33.5 mt -82.18 118.58 23.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.897 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -116.94 119.6 35.83 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.995 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.554 ' HB2' HD11 ' A' ' 53' ' ' LEU . 0.8 OUTLIER -90.63 117.27 29.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.82 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.7 115.65 22.44 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.827 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -86.53 -72.21 0.51 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.053 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -134.9 -67.43 0.56 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.608 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -122.78 18.56 10.26 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.207 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.0 tp -131.68 138.22 48.62 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.604 0.24 . . . . 0.0 110.979 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.97 122.52 39.54 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.765 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.8 mp -114.44 131.14 67.36 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.684 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.2 tt -92.13 127.88 37.77 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.874 0.369 . . . . 0.0 111.116 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.782 ' CD2' HD12 ' A' ' 59' ' ' LEU . 5.8 mp -92.95 90.06 6.8 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.789 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.88 -31.82 15.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.145 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -132.08 174.49 10.14 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.989 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.59 -32.05 72.98 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.294 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -54.28 -42.2 69.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.71 0.29 . . . . 0.0 110.94 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.64 -46.19 83.59 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.162 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.782 HD12 ' CD2' ' A' ' 53' ' ' LEU . 2.3 tp -61.77 -41.92 98.32 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.599 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.841 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.5 t0 -61.52 -41.77 97.81 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.734 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.87 -39.49 94.33 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.835 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.435 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -62.81 -38.42 90.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.333 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.841 HD12 ' HA ' ' A' ' 60' ' ' ASP . 7.5 mt -64.37 -44.04 97.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.599 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -56.0 -42.4 76.35 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.052 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.435 HD12 ' HA ' ' A' ' 62' ' ' ALA . 17.1 mt -66.12 -45.57 90.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.112 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.454 ' CD2' HD11 ' A' ' 75' ' ' LEU . 8.4 tp -58.9 -43.47 91.04 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.803 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -69.29 -36.77 77.38 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.036 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -26.64 68.8 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.27 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.2 t -62.36 164.72 6.83 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.912 0.386 . . . . 0.0 111.382 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 p -64.06 -40.72 96.89 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.185 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.5 p -163.93 -63.92 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.232 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 63.16 -177.58 0.15 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.135 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -152.61 115.41 4.57 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.789 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.513 ' C ' HD12 ' A' ' 75' ' ' LEU . 0.4 OUTLIER 64.06 -172.2 0.17 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.954 -179.872 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.513 HD12 ' C ' ' A' ' 74' ' ' SER . 8.2 mp -125.39 125.85 44.06 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.721 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -86.2 107.07 17.73 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.914 0.387 . . . . 0.0 110.606 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.54 HG21 HD22 ' A' ' 42' ' ' LEU . 8.2 mt -127.85 131.53 69.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.723 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.47 ' HA ' HD13 ' A' ' 78' ' ' LEU . 3.6 mm? -101.93 128.95 48.11 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.538 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.588 HD11 ' HB3' ' A' ' 8' ' ' PHE . 1.4 mt -94.15 133.65 37.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.023 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.7 mt -135.37 143.78 46.25 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.146 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t . . . . . 0 C--O 1.233 0.213 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.899 179.87 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 . . . . . 0 N--CA 1.465 0.298 0 CA-C-O 120.653 0.263 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -138.75 141.43 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.245 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -95.01 105.5 17.42 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.916 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.455 HG23 HD12 ' A' ' 75' ' ' LEU . 2.7 mt -111.72 116.96 53.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.882 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -96.1 118.31 32.43 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.75 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.669 ' HB3' HD11 ' A' ' 79' ' ' LEU . 36.4 m-85 -96.83 129.17 44.3 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.019 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.405 ' O ' HD12 ' A' ' 79' ' ' LEU . 5.4 tt0 -119.09 128.68 54.55 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.875 0.369 . . . . 0.0 111.691 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -142.2 120.1 11.99 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.525 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 44.1 t30 54.96 38.28 30.21 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.793 0.33 . . . . 0.0 111.072 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 84.52 -14.51 46.09 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 121.168 -0.539 . . . . 0.0 113.588 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -87.32 121.02 29.22 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 117.22 0.51 . . . . 0.0 110.855 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -100.33 154.45 18.48 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.369 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.9 mtt-85 -140.04 139.97 36.07 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.913 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.9 mt -108.75 114.79 47.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.225 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.8 mt -139.88 136.06 38.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.235 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.69 133.57 41.06 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.303 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.412 ' HB2' ' CD1' ' A' ' 6' ' ' ILE . 21.5 m-85 -121.86 129.36 52.53 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.89 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.24 157.87 25.03 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.869 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.421 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 2.0 mtm105 -109.51 153.98 42.56 Favored Pre-proline 0 C--O 1.234 0.253 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.113 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.421 ' HA ' ' HB3' ' A' ' 21' ' ' ARG . 72.9 Cg_endo -75.74 131.79 25.4 Favored 'Cis proline' 0 C--N 1.349 0.593 0 C-N-CA 123.189 -1.588 . . . . 0.0 112.756 0.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.9 p -105.6 125.73 60.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.871 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -87.04 137.46 32.33 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.727 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.484 ' CE1' HD12 ' A' ' 42' ' ' LEU . 65.5 t80 -55.68 -38.72 70.01 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.754 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.06 -43.49 95.39 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.165 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -62.63 -43.8 97.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.166 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.498 ' O ' HG23 ' A' ' 32' ' ' VAL . 39.8 t -69.09 -45.15 80.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.457 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -61.81 -38.4 87.96 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.358 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.87 -47.46 82.65 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.807 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.675 ' O ' HG23 ' A' ' 35' ' ' VAL . 11.2 mtpp -61.4 -46.59 89.52 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.894 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 28' ' ' VAL . 48.2 t -57.47 -48.17 83.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.919 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.7 m -62.33 -39.37 92.87 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.37 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.1 m -71.71 -46.26 59.23 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 31' ' ' LYS . 61.7 t -61.44 -50.16 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.514 0.197 . . . . 0.0 111.488 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -83.4 -21.46 33.01 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.41 30.35 64.75 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.812 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.569 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -168.2 151.87 5.78 Favored Pre-proline 0 N--CA 1.463 0.2 0 CA-C-N 116.59 0.195 . . . . 0.0 111.081 -179.968 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -75.17 107.38 2.47 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.573 2.182 . . . . 0.0 112.236 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.569 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.4 mp -105.44 143.16 33.99 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.298 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -88.62 129.46 35.5 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.781 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.742 HD23 HD23 ' A' ' 79' ' ' LEU . 50.7 mt -86.12 103.01 14.37 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.904 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -93.08 120.92 33.89 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.101 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.55 ' CE2' ' HB1' ' A' ' 62' ' ' ALA . 0.6 OUTLIER -96.86 125.38 41.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.994 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.2 ptp -126.65 114.23 17.76 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.035 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -86.94 -54.3 4.42 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.801 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -157.13 -65.81 0.1 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.506 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -126.2 13.23 7.74 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.533 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.6 tp -131.62 132.96 44.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.628 0.251 . . . . 0.0 110.961 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 m -110.51 126.07 53.99 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.963 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.0 mt -114.63 134.12 58.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.89 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 tt -92.08 122.3 34.45 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.81 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.427 HD21 ' HA ' ' A' ' 59' ' ' LEU . 3.1 mt -80.39 87.26 5.65 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.058 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.98 -31.75 14.78 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.382 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -142.85 -179.63 6.46 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.891 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -62.68 -31.35 72.23 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.14 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.24 -43.81 67.62 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.1 0.25 . . . . 0.0 111.099 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.25 -40.05 89.94 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.188 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.427 ' HA ' HD21 ' A' ' 53' ' ' LEU . 6.5 tp -69.3 -41.38 76.84 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.763 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -65.89 -40.21 91.34 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.341 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.8 tptt -62.67 -36.94 84.5 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.396 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.55 ' HB1' ' CE2' ' A' ' 44' ' ' TYR . . . -63.06 -38.31 90.69 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.343 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 54.0 mt -62.75 -42.52 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.005 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.25 -45.54 72.39 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.119 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 4.9 mt -69.37 -41.92 81.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.906 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.476 HD22 HD22 ' A' ' 75' ' ' LEU . 13.7 tp -61.39 -44.52 97.01 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.029 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -61.47 -39.26 90.24 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.045 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 7.8 mtm-85 -62.65 -34.3 76.79 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.243 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.0 t -87.01 119.98 27.78 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.806 0.336 . . . . 0.0 111.212 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 71.9 m -78.19 -32.47 50.08 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.253 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.6 p -93.47 35.7 1.1 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.699 0.285 . . . . 0.0 111.612 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.42 ' HE2' HD12 ' A' ' 66' ' ' LEU . 3.8 ttp -147.41 80.96 1.52 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.821 0.343 . . . . 0.0 110.816 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -103.18 31.44 4.27 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.335 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.5 m -156.52 142.52 18.03 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.65 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.879 HD12 HD11 ' A' ' 77' ' ' ILE . 0.1 OUTLIER -116.46 131.94 56.81 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 111.189 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -99.72 118.15 35.61 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.048 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.879 HD11 HD12 ' A' ' 75' ' ' LEU . 2.3 mp -125.22 132.39 71.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.759 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 mt -101.94 119.42 38.77 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.679 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.742 HD23 HD23 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -93.39 119.95 33.1 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.998 -179.805 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 pp -130.9 136.54 48.69 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.978 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 54.7 p . . . . . 0 C--N 1.331 -0.211 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.788 179.716 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.728 0.299 . . . . 0.0 110.424 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.522 HG11 HD12 ' A' ' 63' ' ' ILE . 21.2 t -78.21 135.82 25.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.857 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.95 107.25 18.3 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.857 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.567 HD12 ' HD2' ' A' ' 19' ' ' PHE . 27.3 mt -110.01 120.6 61.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.977 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.09 119.2 38.4 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.669 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.905 ' HB3' HD11 ' A' ' 79' ' ' LEU . 49.7 m-85 -100.74 127.2 47.26 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.481 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.409 ' O ' HD12 ' A' ' 79' ' ' LEU . 25.8 tt0 -118.82 131.2 56.08 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.874 0.369 . . . . 0.0 111.37 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -141.74 120.62 12.75 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.513 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 m120 56.13 34.99 24.9 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.511 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.13 -14.19 61.37 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 120.915 -0.659 . . . . 0.0 113.159 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -89.43 116.93 27.98 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 117.055 0.428 . . . . 0.0 110.429 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.14 144.16 39.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.394 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.1 mtt-85 -133.98 139.41 46.06 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.9 mp -102.27 118.59 49.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.235 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -137.04 129.96 44.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.974 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.31 142.87 27.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.118 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.567 ' HD2' HD12 ' A' ' 6' ' ' ILE . 43.1 m-85 -133.84 118.08 17.57 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.941 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.5 t -64.62 130.47 43.75 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.977 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.435 ' HG3' HG23 ' A' ' 4' ' ' VAL . 4.0 mtm180 -74.46 160.02 82.18 Favored Pre-proline 0 CA--C 1.53 0.195 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.346 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.86 130.17 19.9 Favored 'Cis proline' 0 C--N 1.35 0.609 0 C-N-CA 123.219 -1.576 . . . . 0.0 112.558 -0.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -71.61 125.18 29.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.021 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.445 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -102.17 137.94 39.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.928 -179.709 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -55.91 -45.03 78.79 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.735 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -39.69 94.44 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.03 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.12 -44.41 95.71 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.105 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 24' ' ' LYS . 42.6 t -67.97 -48.42 74.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.881 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -39.24 93.48 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.111 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -58.0 -39.4 78.17 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.933 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.732 ' O ' HG23 ' A' ' 35' ' ' VAL . 4.1 tptt -69.23 -47.49 64.59 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.062 179.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.551 HG11 HD22 ' A' ' 79' ' ' LEU . 25.6 t -68.24 -43.6 84.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.477 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.7 m -60.38 -38.66 84.6 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.102 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.4 m -71.49 -43.79 65.91 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 111.464 0.172 . . . . 0.0 111.464 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.732 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.1 t -63.34 -50.86 77.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 120.535 0.207 . . . . 0.0 111.42 -179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -83.48 -18.68 37.7 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.21 21.06 75.55 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 121.067 -0.587 . . . . 0.0 113.052 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.515 ' O ' HD12 ' A' ' 40' ' ' LEU . 34.1 mt-30 -149.71 151.64 33.23 Favored Pre-proline 0 CA--C 1.53 0.178 0 CA-C-N 116.94 0.37 . . . . 0.0 110.933 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -75.32 95.0 0.97 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.634 2.223 . . . . 0.0 112.122 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 38' ' ' GLN . 5.8 mp -93.52 145.32 24.6 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.232 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.452 ' OD2' HD11 ' A' ' 52' ' ' LEU . 4.2 t0 -91.96 130.92 37.61 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.733 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.625 HD23 HG21 ' A' ' 77' ' ' ILE . 4.3 mp -90.2 103.08 15.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.946 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.629 ' CE1' HD12 ' A' ' 52' ' ' LEU . 8.5 m-70 -94.71 120.08 34.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.197 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -99.08 120.54 39.64 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.537 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.02 129.67 56.17 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.671 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -90.46 -50.67 5.82 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.735 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -171.99 -63.63 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.454 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -109.19 -26.69 9.97 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.397 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.27 138.99 40.6 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.754 0.312 . . . . 0.0 111.279 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.2 t -110.31 129.64 55.7 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.888 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.7 mt -120.01 134.09 64.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.811 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.629 HD12 ' CE1' ' A' ' 43' ' ' HIS . 3.3 tt -99.32 135.1 41.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.676 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.508 HD21 ' HA ' ' A' ' 59' ' ' LEU . 10.3 mt -73.85 86.48 1.74 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.024 0.44 . . . . 0.0 111.096 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.5 tptp -80.55 -36.63 32.76 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.234 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -152.33 178.54 9.42 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.247 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -58.3 -33.0 68.98 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.09 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.63 -43.47 72.3 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.699 0.285 . . . . 0.0 110.86 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -67.35 -40.44 85.85 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.676 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.508 ' HA ' HD21 ' A' ' 53' ' ' LEU . 9.3 tp -64.49 -44.6 90.45 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.153 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.3 -38.63 91.9 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.139 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.9 mttt -62.99 -41.93 99.7 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.494 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.82 -45.39 92.83 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.183 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.525 HD13 HD11 ' A' ' 75' ' ' LEU . 44.2 mm -65.04 -44.92 95.81 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.134 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.085 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.7 -45.54 85.56 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.379 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.9 mt -70.06 -45.16 77.27 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.969 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.567 HD21 ' O ' ' A' ' 74' ' ' SER . 9.2 tp -63.72 -46.4 85.56 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.375 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.78 -40.78 84.99 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.807 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -68.3 -33.59 74.6 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.101 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.6 t -82.31 113.91 20.43 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.923 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 m -75.25 -29.2 60.14 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.997 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.61 -35.26 65.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.184 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 mmm -108.46 154.85 21.31 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.102 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.6 mmtm -134.77 -52.14 0.8 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.709 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.567 ' O ' HD21 ' A' ' 66' ' ' LEU . 1.9 p -79.0 169.73 17.76 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.034 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.624 HD22 HD11 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -111.58 121.65 45.71 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.044 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.48 108.19 19.5 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.821 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.625 HG21 HD23 ' A' ' 42' ' ' LEU . 27.8 mt -128.94 132.2 67.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.853 HD23 HD11 ' A' ' 80' ' ' LEU . 3.5 tp -102.12 119.48 38.88 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.509 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.905 HD11 ' HB3' ' A' ' 8' ' ' PHE . 2.8 mt -93.54 131.64 38.6 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.955 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.853 HD11 HD23 ' A' ' 78' ' ' LEU . 5.0 mp -142.12 138.45 31.66 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.792 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.463 0.185 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.371 -179.797 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 . . . . . 0 N--CA 1.468 0.455 0 CA-C-O 120.764 0.316 . . . . 0.0 111.508 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.9 t -93.05 130.76 41.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.949 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -87.21 113.94 23.38 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.761 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 mm -106.69 123.98 61.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.21 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.406 ' HD3' HG13 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -108.66 111.8 23.79 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.752 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.655 ' CD2' HD11 ' A' ' 79' ' ' LEU . 11.2 p90 -116.41 149.14 39.91 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.305 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -118.01 139.85 50.6 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.086 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.682 ' HB2' HD12 ' A' ' 79' ' ' LEU . 50.9 t-80 -146.03 114.54 6.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.436 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 t30 58.72 35.01 24.17 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.135 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.72 12.47 81.48 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.071 -0.585 . . . . 0.0 113.177 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -111.29 122.07 46.9 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 117.059 0.43 . . . . 0.0 110.736 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -93.32 139.72 30.34 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.147 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.439 ' HB2' ' CE2' ' A' ' 8' ' ' PHE . 16.0 mmt180 -139.04 136.7 35.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.161 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.406 HG13 ' HD3' ' A' ' 7' ' ' LYS . 2.4 mp -117.01 129.63 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.221 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 32.7 mt -140.92 129.62 24.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.131 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.6 134.61 34.27 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.031 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -129.2 121.48 27.76 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.045 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p -66.39 136.49 55.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.898 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -77.41 147.22 75.31 Favored Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.993 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.83 133.84 31.9 Favored 'Cis proline' 0 C--N 1.35 0.633 0 C-N-CA 123.347 -1.522 . . . . 0.0 112.625 0.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.7 p -81.46 123.45 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.091 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -102.66 143.76 31.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.01 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.552 ' HB2' HD13 ' A' ' 59' ' ' LEU . 62.6 t80 -60.27 -42.1 94.71 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.6 179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.418 ' HG2' ' CD2' ' A' ' 30' ' ' HIS . 12.2 tt0 -57.89 -41.6 82.88 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.098 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -62.48 -44.45 96.37 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.087 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.715 ' O ' HG23 ' A' ' 32' ' ' VAL . 37.3 t -70.99 -48.44 55.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.893 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -40.54 85.01 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.392 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . 0.418 ' CD2' ' HG2' ' A' ' 26' ' ' GLU . 4.5 m-70 -57.9 -46.67 84.59 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.697 0.284 . . . . 0.0 111.06 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.78 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -71.4 -48.26 50.92 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.094 179.986 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 28' ' ' VAL . 48.4 t -56.99 -46.29 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.374 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 91.4 m -61.2 -38.85 88.06 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.952 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.1 m -71.3 -42.27 68.88 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 111.481 0.178 . . . . 0.0 111.481 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.78 HG23 ' O ' ' A' ' 31' ' ' LYS . 41.5 t -60.2 -49.97 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-O 120.607 0.241 . . . . 0.0 111.068 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.686 ' CE2' HD13 ' A' ' 79' ' ' LEU . 69.7 m-85 -83.61 -25.79 30.55 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.883 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.35 14.0 62.7 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.03 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -154.39 152.16 25.6 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.977 0.389 . . . . 0.0 110.872 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -72.46 79.74 1.78 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.641 2.227 . . . . 0.0 112.29 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.7 mp -75.31 140.03 42.85 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.878 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.0 136.81 32.79 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.02 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.536 HD22 HG21 ' A' ' 77' ' ' ILE . 10.9 mt -86.19 118.69 25.8 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.91 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.1 m170 -109.07 119.58 39.96 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.063 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -120.22 128.35 53.28 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.796 0.331 . . . . 0.0 110.672 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.5 mtm -110.49 118.52 36.47 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.377 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -60.8 -67.5 0.39 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.876 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.88 -59.79 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.37 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.456 ' O ' HD22 ' A' ' 49' ' ' LEU . 7.2 mt-10 -120.96 11.6 11.05 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.604 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.456 HD22 ' O ' ' A' ' 48' ' ' GLU . 1.4 mm? -131.22 159.2 38.47 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.689 0.281 . . . . 0.0 111.019 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.4 p -118.1 118.53 32.14 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.05 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.7 mt -113.67 133.9 58.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.858 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.3 tt -96.44 123.29 40.04 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.945 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.734 HD23 ' HB3' ' A' ' 58' ' ' ASP . 7.3 mt -92.34 81.0 4.93 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.864 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.2 tttp -103.5 -32.82 9.29 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.972 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -107.9 165.57 11.36 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.8 0.333 . . . . 0.0 111.102 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.52 -35.85 80.72 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.952 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.47 -42.65 74.63 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.025 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.734 ' HB3' HD23 ' A' ' 53' ' ' LEU . 54.8 m-20 -60.1 -44.48 94.79 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.661 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.552 HD13 ' HB2' ' A' ' 25' ' ' TYR . 4.9 tt -66.28 -40.69 90.27 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.074 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.11 -41.45 96.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.904 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -66.32 -37.27 84.99 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.061 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.509 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.17 -45.42 91.89 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.348 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 42.3 mm -66.11 -41.04 88.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.775 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -55.33 -41.17 72.1 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.085 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.509 HD12 ' HA ' ' A' ' 62' ' ' ALA . 7.6 mt -66.81 -41.43 87.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.922 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.798 HD22 HD21 ' A' ' 75' ' ' LEU . 38.5 tp -62.76 -41.98 99.47 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.007 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -58.62 -38.01 77.13 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.209 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -31.75 64.99 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.298 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.9 t -98.9 93.09 5.84 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.219 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 89.2 p -67.88 -31.31 71.02 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.388 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.2 p -56.43 -43.67 79.65 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.182 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 6.2 ttp -83.47 157.39 22.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.223 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.4 mttm -143.73 -51.28 0.32 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.93 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.9 m -79.6 149.74 31.26 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.076 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.798 HD21 HD22 ' A' ' 66' ' ' LEU . 3.9 mm? -113.9 126.48 55.22 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.898 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.5 mtt-85 -93.02 109.91 21.37 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.944 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.536 HG21 HD22 ' A' ' 42' ' ' LEU . 38.6 mt -128.93 132.2 67.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.094 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.7 mp -102.21 132.03 48.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.673 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.686 HD13 ' CE2' ' A' ' 36' ' ' PHE . 1.7 mt -94.15 132.34 38.78 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.09 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 89.1 mt -143.63 137.31 28.21 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.905 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 p . . . . . 0 C--O 1.233 0.196 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.131 -179.813 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 . . . . . 0 C--O 1.234 0.25 0 CA-C-O 121.014 0.435 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -85.72 135.88 24.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.173 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -95.84 106.16 18.26 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.888 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.442 HD12 ' CD2' ' A' ' 19' ' ' PHE . 33.3 mt -101.09 126.38 54.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.018 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -98.83 116.37 30.91 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.913 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -93.38 145.63 24.34 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.247 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.32 132.76 50.2 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.348 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -146.14 113.85 6.42 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.626 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 58.3 33.74 23.42 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.12 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.96 -13.64 62.56 Favored Glycine 0 CA--C 1.526 0.719 0 C-N-CA 120.917 -0.659 . . . . 0.0 113.048 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -77.05 152.58 35.03 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 117.007 0.404 . . . . 0.0 110.949 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -115.54 144.7 43.49 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.4 144.85 46.78 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.925 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.4 mt -115.51 120.28 64.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.18 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 31.3 mt -141.62 126.58 17.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.238 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.51 135.24 33.99 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.162 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.442 ' CD2' HD12 ' A' ' 6' ' ' ILE . 37.1 m-85 -127.02 128.37 46.23 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.051 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.9 p -87.1 123.06 31.75 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.669 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -64.91 154.08 86.96 Favored Pre-proline 0 C--O 1.233 0.232 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.264 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.39 127.34 14.79 Favored 'Cis proline' 0 C--N 1.35 0.616 0 C-N-CA 123.343 -1.524 . . . . 0.0 112.733 0.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.9 p -84.26 122.83 38.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.887 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.684 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -98.55 142.69 29.83 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.079 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.746 ' CE1' HD12 ' A' ' 42' ' ' LEU . 70.9 t80 -60.39 -42.41 95.84 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.987 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.416 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 16.2 mt-10 -61.56 -39.41 91.01 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.954 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -68.75 -44.28 74.07 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.015 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 24' ' ' LYS . 29.1 t -62.22 -48.02 90.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.838 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.416 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 10.8 pt-20 -63.78 -34.79 78.68 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.261 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.2 -48.38 80.51 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.047 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -63.48 -40.59 97.5 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.743 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 28' ' ' VAL . 41.8 t -64.97 -44.19 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.314 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 m -65.23 -38.88 91.75 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.965 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 m -71.55 -47.35 55.65 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.46 HG13 ' N ' ' A' ' 36' ' ' PHE . 13.5 p -59.92 -48.8 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.692 ' CE2' HD13 ' A' ' 79' ' ' LEU . 65.6 m-85 -84.01 -18.11 38.22 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.47 28.47 69.53 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.711 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.473 ' O ' HD12 ' A' ' 40' ' ' LEU . 1.2 pt20 -162.49 156.32 17.88 Favored Pre-proline 0 CA--C 1.529 0.158 0 CA-C-N 116.725 0.263 . . . . 0.0 110.922 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.04 107.12 2.29 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.664 2.243 . . . . 0.0 112.526 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.503 HD23 ' HB3' ' A' ' 79' ' ' LEU . 6.1 mp -108.65 126.44 52.98 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.029 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.44 135.4 39.41 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.842 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.746 HD12 ' CE1' ' A' ' 25' ' ' TYR . 73.5 mt -83.18 95.59 8.16 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.932 0.396 . . . . 0.0 110.536 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 -87.56 118.01 26.75 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.188 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.471 ' CD1' HD12 ' A' ' 51' ' ' ILE . 18.9 t80 -107.52 118.63 37.23 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.447 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.4 mmm -117.61 131.65 56.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.06 -48.74 7.83 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.586 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -173.15 -62.66 0.02 OUTLIER 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.482 179.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -111.29 -25.29 9.75 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.81 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.628 HD13 ' N ' ' A' ' 50' ' ' SER . 1.1 tm? -101.38 132.22 47.07 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 111.261 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.628 ' N ' HD13 ' A' ' 49' ' ' LEU . 1.0 OUTLIER -97.81 127.62 43.88 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.988 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.471 HD12 ' CD1' ' A' ' 44' ' ' TYR . 22.0 mt -118.11 131.51 70.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.011 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.4 tt -101.31 121.74 42.44 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.807 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.727 HD12 ' HB3' ' A' ' 42' ' ' LEU . 43.9 mt -79.14 100.64 7.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.65 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.52 -34.99 11.84 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.118 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -141.61 178.52 7.41 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.901 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -32.79 73.65 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.268 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.1 -47.68 71.52 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.648 0.261 . . . . 0.0 111.145 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -65.59 -46.2 80.31 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.0 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.456 HD13 HD13 ' A' ' 53' ' ' LEU . 10.3 tp -62.71 -42.46 99.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.146 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.24 -36.38 81.53 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.066 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.86 -36.48 83.4 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.651 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.549 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -65.22 -36.42 84.1 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.113 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.726 ' CD1' HD21 ' A' ' 75' ' ' LEU . 25.8 mm -64.56 -46.07 93.68 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.903 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.81 -40.25 69.34 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.267 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.549 HD12 ' HA ' ' A' ' 62' ' ' ALA . 11.7 mt -68.35 -45.63 82.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.893 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.3 tp -66.6 -42.62 86.61 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.027 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.85 -42.65 84.9 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.111 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -69.81 -30.4 67.92 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.925 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.5 t -69.2 146.69 52.18 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.817 0.342 . . . . 0.0 111.147 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.4 m -75.84 -20.83 57.82 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.617 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 76.1 p -94.43 38.69 1.09 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.792 0.329 . . . . 0.0 111.426 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.38 120.64 24.09 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.594 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.35 -68.18 0.19 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.963 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.31 173.19 8.54 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.872 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.726 HD21 ' CD1' ' A' ' 63' ' ' ILE . 5.3 mp -109.24 125.76 52.6 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.12 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 26.9 ttt180 -86.7 107.33 18.17 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.708 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.743 HG21 HD22 ' A' ' 42' ' ' LEU . 28.9 mt -129.7 131.89 66.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.963 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.4 mt -102.03 127.64 48.82 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.817 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.692 HD13 ' CE2' ' A' ' 36' ' ' PHE . 40.0 mt -93.74 119.67 33.02 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.101 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mp -144.95 144.89 31.3 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.917 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.234 0.26 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.82 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.467 0.386 0 CA-C-O 120.746 0.308 . . . . 0.0 111.071 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.3 t -108.74 139.82 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.205 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.61 113.31 25.38 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.225 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.649 HD12 ' CD2' ' A' ' 19' ' ' PHE . 24.0 mt -110.14 123.93 66.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.823 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.418 ' HG3' ' HB3' ' A' ' 74' ' ' SER . 9.0 mttm -95.92 119.94 35.32 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.663 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.843 ' HB3' HD11 ' A' ' 79' ' ' LEU . 97.8 m-85 -106.58 141.26 38.16 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.098 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -120.82 125.75 48.35 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.126 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.441 ' HB2' HD12 ' A' ' 79' ' ' LEU . 5.6 t-160 -140.65 116.75 10.53 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.603 179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 57.65 32.92 22.57 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.142 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.77 -14.25 60.63 Favored Glycine 0 CA--C 1.525 0.711 0 C-N-CA 120.876 -0.678 . . . . 0.0 113.137 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.76 129.02 34.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.963 0.382 . . . . 0.0 110.859 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.61 135.01 45.02 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.949 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -139.51 143.95 37.7 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.423 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.8 mp -116.37 121.25 67.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.94 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.2 mm -123.4 136.35 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.347 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -100.22 134.12 43.62 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.011 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.649 ' CD2' HD12 ' A' ' 6' ' ' ILE . 81.0 m-85 -128.0 125.87 40.25 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.091 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.2 t -85.56 150.97 24.28 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.97 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -86.62 150.78 51.77 Favored Pre-proline 0 CA--C 1.529 0.173 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.428 179.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.09 127.22 14.61 Favored 'Cis proline' 0 C--N 1.349 0.582 0 C-N-CA 123.573 -1.428 . . . . 0.0 112.752 0.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.5 p -93.07 129.88 42.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.057 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.454 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -100.59 143.63 30.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.104 -179.713 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -57.36 -52.58 64.79 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.872 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.03 -35.27 74.73 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.036 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -62.39 -44.77 95.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.719 0.295 . . . . 0.0 110.987 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 24' ' ' LYS . 39.6 t -67.69 -48.43 76.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.52 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -62.75 -36.84 84.36 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.46 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -57.69 -45.03 86.18 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.026 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.671 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.6 OUTLIER -61.13 -46.48 90.41 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.776 179.793 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.653 HG11 HD22 ' A' ' 79' ' ' LEU . 33.8 t -61.65 -47.45 93.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.208 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 m -65.69 -38.74 90.09 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.388 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.0 m -71.5 -48.48 48.7 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 111.55 0.204 . . . . 0.0 111.55 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.671 HG23 ' O ' ' A' ' 31' ' ' LYS . 59.9 t -61.39 -50.06 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.474 0.178 . . . . 0.0 111.36 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.629 ' HE2' HD13 ' A' ' 79' ' ' LEU . 24.4 m-85 -80.74 -20.13 43.43 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.47 34.41 73.85 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.802 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.455 ' OE1' ' HB3' ' A' ' 81' ' ' SER . 1.1 pt20 -167.6 149.65 5.33 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.73 0.265 . . . . 0.0 111.238 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.65 126.84 8.44 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.76 2.307 . . . . 0.0 112.709 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.426 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.4 mp -133.79 144.51 49.07 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.919 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.34 130.17 37.23 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.636 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 53' ' ' LEU . 1.1 mp -81.6 116.74 21.5 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.083 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.412 ' ND1' HD21 ' A' ' 80' ' ' LEU . 3.8 m80 -102.03 121.26 41.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.186 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.554 ' HD2' HD11 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -94.62 128.78 41.5 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.794 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.2 ptt? -131.59 114.56 14.99 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.742 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -90.57 -66.01 0.96 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.718 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -146.04 -70.42 0.26 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.409 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -112.46 -16.0 12.98 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.62 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -110.7 139.78 45.67 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.802 0.334 . . . . 0.0 111.253 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.1 m -120.77 124.68 45.71 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.598 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.9 mt -114.96 134.44 58.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.024 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.432 HD23 ' N ' ' A' ' 53' ' ' LEU . 4.1 tt -92.0 129.37 37.97 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.185 -179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.554 HD11 ' HD2' ' A' ' 44' ' ' TYR . 8.2 mt -82.36 90.44 6.68 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.058 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -106.74 -33.67 7.53 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.158 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.05 167.08 11.47 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.062 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.36 -37.07 85.92 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.061 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -55.47 -37.59 67.97 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.238 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.481 ' HB3' HD23 ' A' ' 53' ' ' LEU . 2.0 t70 -65.52 -41.74 92.78 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.672 0.273 . . . . 0.0 110.819 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.438 HD12 HD22 ' A' ' 53' ' ' LEU . 0.6 OUTLIER -66.79 -42.29 86.21 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.979 179.73 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -68.79 -41.64 78.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.009 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -36.49 81.9 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.818 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.536 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -64.83 -40.43 95.18 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.369 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.0 mt -65.06 -41.44 91.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.035 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -53.41 -44.42 68.73 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.173 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 37.5 mt -68.85 -44.2 81.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.05 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.48 -43.41 97.38 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.925 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -60.51 -40.45 91.46 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.36 -32.84 73.21 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.16 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.3 t -89.33 107.63 19.17 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.291 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 12.9 t -70.64 -29.03 65.28 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.672 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 p -60.71 -61.72 2.38 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.0 ttt -76.32 115.76 16.37 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.767 0.318 . . . . 0.0 111.248 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.8 mttm -93.11 -37.02 12.36 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.426 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.418 ' HB3' ' HG3' ' A' ' 7' ' ' LYS . 1.7 m -110.72 166.17 11.23 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.625 0.25 . . . . 0.0 111.108 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.637 ' CD1' HG23 ' A' ' 6' ' ' ILE . 0.3 OUTLIER -116.86 136.7 52.75 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.107 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.435 ' O ' HD13 ' A' ' 77' ' ' ILE . 3.5 mtp85 -86.32 116.59 24.58 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.158 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.607 HD11 HD12 ' A' ' 75' ' ' LEU . 24.2 mm -126.65 129.84 71.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.227 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.3 mp -102.15 125.67 48.9 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.607 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.843 HD11 ' HB3' ' A' ' 8' ' ' PHE . 2.0 mt -98.08 129.44 44.91 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.089 -179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.412 HD21 ' ND1' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -149.62 135.41 18.65 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.253 179.822 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.455 ' HB3' ' OE1' ' A' ' 38' ' ' GLN . 81.6 p . . . . . 0 C--O 1.234 0.251 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.456 179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 t70 . . . . . 0 C--O 1.232 0.183 0 CA-C-O 120.805 0.336 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -98.93 131.66 45.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.034 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.43 ' HE ' HG21 ' A' ' 16' ' ' ILE . 7.2 ttt180 -90.16 105.56 17.89 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.893 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.629 HG23 ' HB2' ' A' ' 75' ' ' LEU . 1.9 mp -111.15 135.13 51.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.056 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -104.25 121.23 42.87 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.698 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.518 ' HD2' HD11 ' A' ' 79' ' ' LEU . 11.3 m-85 -99.85 142.24 31.59 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.084 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -131.69 125.54 32.33 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -148.86 117.67 6.66 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.686 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 58.0 31.47 20.68 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.456 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.87 -14.44 58.62 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.087 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -85.08 106.98 16.95 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 117.013 0.406 . . . . 0.0 110.378 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -101.21 144.07 30.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.013 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -143.01 157.94 44.07 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.364 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.43 HG21 ' HE ' ' A' ' 5' ' ' ARG . 3.8 mp -115.98 123.07 70.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.821 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 30.9 mt -130.86 138.63 53.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.181 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.24 133.97 34.59 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.125 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -128.13 117.63 21.96 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 97.6 p -76.21 145.89 39.46 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.126 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -98.91 154.52 37.32 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.032 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.34 120.71 7.14 Favored 'Cis proline' 0 C--N 1.351 0.704 0 C-N-CA 123.335 -1.527 . . . . 0.0 112.796 0.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -75.57 129.46 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.266 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.422 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -97.73 139.29 33.82 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.973 -179.941 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -55.31 -44.25 75.62 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.765 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.71 -41.15 94.66 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.924 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.4 -44.44 96.43 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.116 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 24' ' ' LYS . 22.2 t -65.88 -48.63 81.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.823 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -58.44 -39.97 81.3 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.241 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -40.24 80.25 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.754 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.68 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.4 OUTLIER -68.54 -48.13 65.11 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.993 179.515 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 28' ' ' VAL . 23.2 t -60.02 -42.62 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.344 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.6 m -61.37 -39.0 89.04 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.924 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.9 m -71.49 -46.98 58.34 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 111.47 0.174 . . . . 0.0 111.47 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 31' ' ' LYS . 36.8 t -58.27 -50.05 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.474 ' CE2' HD13 ' A' ' 79' ' ' LEU . 24.9 m-85 -83.6 -24.67 31.39 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.17 28.25 58.59 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.848 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.503 ' O ' HD12 ' A' ' 40' ' ' LEU . 1.5 pt20 -173.08 159.63 3.49 Favored Pre-proline 0 N--CA 1.464 0.226 0 CA-C-N 116.712 0.256 . . . . 0.0 110.973 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.433 ' HD2' ' HB2' ' A' ' 38' ' ' GLN . 56.3 Cg_endo -71.23 109.73 2.66 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.631 2.221 . . . . 0.0 112.524 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.503 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.9 mp -115.59 154.82 28.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.091 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -98.17 141.9 30.52 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.779 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.443 ' N ' HD23 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -108.49 100.06 9.38 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.695 179.783 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.0 m170 -92.14 131.04 37.7 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.418 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -107.03 121.94 45.46 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.486 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 7.7 mmt -109.32 114.75 28.69 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.62 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -72.3 -56.58 5.26 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.734 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -170.77 -58.6 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.574 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -117.44 2.57 12.45 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.676 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.709 HD12 HD11 ' A' ' 51' ' ' ILE . 0.5 OUTLIER -131.76 159.59 38.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.784 0.326 . . . . 0.0 111.659 -179.851 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.87 125.08 49.84 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.262 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.709 HD11 HD12 ' A' ' 49' ' ' LEU . 28.0 mm -116.14 132.11 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.851 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -96.33 126.82 41.8 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.817 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.496 HD21 ' HA ' ' A' ' 59' ' ' LEU . 7.0 mt -87.56 92.11 8.98 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.761 0.315 . . . . 0.0 110.764 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.9 pttt -107.46 -34.38 7.07 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.416 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -131.54 171.04 13.9 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.712 0.291 . . . . 0.0 111.033 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -31.54 71.19 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.922 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -54.09 -44.77 71.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.664 0.269 . . . . 0.0 111.029 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.446 ' HB2' HD23 ' A' ' 53' ' ' LEU . 61.1 m-20 -67.21 -36.76 82.4 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.809 179.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.496 ' HA ' HD21 ' A' ' 53' ' ' LEU . 1.3 tp -68.86 -41.85 77.87 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.095 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.58 -41.1 96.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.066 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -62.99 -39.21 94.07 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.847 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.3 -43.67 97.17 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.078 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 43.9 mm -65.37 -41.49 91.34 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.826 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.48 -43.26 75.38 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.971 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.0 mt -67.83 -42.44 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.881 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.9 tp -67.36 -39.23 85.69 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.399 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.57 -37.51 86.45 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.695 0.283 . . . . 0.0 110.924 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -32.37 62.78 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.511 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.3 p -78.48 119.45 21.8 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.03 0.443 . . . . 0.0 111.162 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.49 -29.5 56.85 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.674 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.1 p -93.67 34.58 1.18 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 120.634 0.254 . . . . 0.0 111.678 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.5 mtm -149.98 123.21 8.93 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.667 0.27 . . . . 0.0 111.022 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.55 -46.97 2.35 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.684 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.1 t -83.65 174.09 10.81 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.951 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.629 ' HB2' HG23 ' A' ' 6' ' ' ILE . 2.3 mp -119.07 135.29 54.72 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.903 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.9 mtt85 -102.0 107.49 18.63 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.727 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 9.0 mt -129.58 131.79 66.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.868 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.07 119.48 38.86 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.604 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.518 HD11 ' HD2' ' A' ' 8' ' ' PHE . 2.6 mt -93.42 129.44 39.57 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.116 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mp -138.58 134.95 34.47 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.086 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.466 0.344 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.96 179.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.466 0.333 0 CA-C-O 120.817 0.341 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -75.46 143.68 12.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.075 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.4 mtp85 -95.36 114.65 26.44 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.769 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.729 HD13 ' HD2' ' A' ' 19' ' ' PHE . 4.6 mp -115.4 134.74 57.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.269 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.69 127.47 47.09 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.785 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -107.46 138.46 43.63 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.059 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -130.47 124.18 31.41 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.105 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.54 ' HB2' HD12 ' A' ' 79' ' ' LEU . 1.9 t-160 -147.06 127.91 14.42 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.633 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.08 27.68 16.71 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.489 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.45 -13.98 60.78 Favored Glycine 0 CA--C 1.526 0.728 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.13 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -83.04 163.44 20.96 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 117.004 0.402 . . . . 0.0 111.119 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.1 mtt180 -120.65 153.03 37.42 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.251 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.1 141.15 28.55 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.02 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mt -111.73 119.02 59.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.877 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.16 130.34 34.24 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 120.925 0.393 . . . . 0.0 111.218 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.57 135.68 40.62 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.055 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.729 ' HD2' HD13 ' A' ' 6' ' ' ILE . 39.2 m-85 -122.93 126.65 47.65 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.11 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.3 m -72.63 138.56 46.81 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.015 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.26 152.68 38.71 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.964 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.2 132.31 26.89 Favored 'Cis proline' 0 C--N 1.349 0.594 0 C-N-CA 123.275 -1.552 . . . . 0.0 112.726 0.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -110.65 130.45 63.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.118 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.71 144.91 25.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.014 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -54.71 -37.4 65.81 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.193 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -59.35 -45.07 92.41 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.046 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.47 -44.21 95.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.105 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.494 ' O ' HG23 ' A' ' 32' ' ' VAL . 22.4 t -65.43 -48.82 81.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.891 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -56.68 -41.42 77.29 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.839 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -57.67 -42.32 83.33 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.737 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.642 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -66.8 -47.64 71.47 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.131 179.595 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 28' ' ' VAL . 25.5 t -57.53 -45.65 86.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.138 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.9 m -62.66 -38.78 91.67 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.087 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.3 m -71.48 -46.91 58.59 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.3 t -60.68 -49.92 82.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.702 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 35.4 m-85 -83.84 -21.96 31.87 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.54 -16.74 60.09 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 120.735 -0.745 . . . . 0.0 113.06 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.607 ' O ' HD12 ' A' ' 40' ' ' LEU . 11.5 pt20 -146.11 158.0 49.0 Favored Pre-proline 0 CA--C 1.531 0.227 0 CA-C-N 116.846 0.323 . . . . 0.0 110.758 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.99 129.61 14.46 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.573 2.182 . . . . 0.0 112.489 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.607 HD12 ' O ' ' A' ' 38' ' ' GLN . 4.7 mp -120.86 151.91 39.06 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.36 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.24 137.64 32.17 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.611 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.522 HD22 HG21 ' A' ' 77' ' ' ILE . 3.1 mt -98.76 107.03 19.37 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.942 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.457 ' CE1' HD13 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -93.75 114.89 27.27 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.048 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -95.12 129.07 42.36 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 21.8 ptm -127.11 121.63 31.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.712 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -86.34 -60.05 2.11 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.358 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -154.12 -67.97 0.14 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.273 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.59 -21.39 12.15 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.683 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mp -104.65 140.38 38.12 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.768 0.318 . . . . 0.0 111.311 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.91 122.36 46.75 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.827 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.5 mt -113.95 132.52 62.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.83 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.457 HD13 ' CE1' ' A' ' 43' ' ' HIS . 31.2 tp -93.3 134.84 35.1 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.759 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 56.1 mt -87.37 107.57 18.59 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.997 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.57 -35.72 6.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.306 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -136.87 180.0 6.04 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.39 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.405 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 4.8 tp60 -64.32 -34.33 77.88 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.122 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.04 -40.35 73.36 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.796 -0.183 . . . . 0.0 111.283 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -66.36 -50.02 64.96 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.422 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.466 HD12 ' N ' ' A' ' 60' ' ' ASP . 3.9 pp -69.79 -34.38 73.65 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.968 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.78 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.2 t0 -61.31 -43.76 98.33 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.62 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -70.22 -32.75 70.77 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.07 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.821 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.81 -39.32 93.94 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.319 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.78 HD12 ' HA ' ' A' ' 60' ' ' ASP . 5.8 mt -61.08 -47.37 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.736 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -53.18 -37.32 61.81 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.157 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.821 HD12 ' HA ' ' A' ' 62' ' ' ALA . 17.0 mt -64.91 -38.38 82.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.067 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.52 HD11 ' HG ' ' A' ' 75' ' ' LEU . 14.5 mt -66.55 -46.99 74.26 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.984 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.12 -38.16 85.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.199 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -28.74 67.91 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.47 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.1 p -62.44 165.83 5.74 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.956 0.407 . . . . 0.0 111.519 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.88 -43.16 18.56 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.198 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 57.6 p -127.62 -35.06 2.16 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -50.45 91.45 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -106.73 -32.35 8.02 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.168 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.6 p -69.12 -179.85 1.68 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.63 0.252 . . . . 0.0 111.09 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.553 ' HB3' HD11 ' A' ' 77' ' ' ILE . 3.1 mp -129.69 117.64 20.65 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.723 0.297 . . . . 0.0 111.525 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -86.89 106.89 18.08 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.246 179.356 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.553 HD11 ' HB3' ' A' ' 75' ' ' LEU . 2.6 mt -129.78 130.8 66.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.111 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -103.9 129.61 51.44 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.578 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.702 HD13 ' CZ ' ' A' ' 36' ' ' PHE . 4.9 mt -93.63 129.11 40.02 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.25 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.419 HD12 ' C ' ' A' ' 79' ' ' LEU . 5.8 mp -138.3 134.08 33.86 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.072 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.7 m . . . . . 0 N--CA 1.463 0.219 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.297 -179.79 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.771 0.319 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.28 138.99 52.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.148 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.61 113.73 25.22 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.031 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.481 HD12 ' CD2' ' A' ' 19' ' ' PHE . 21.3 mt -104.93 117.44 50.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.974 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -98.41 127.16 44.22 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.022 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.753 ' CD1' HD12 ' A' ' 17' ' ' ILE . 33.5 m-85 -110.71 147.87 33.48 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.025 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -129.56 132.76 46.91 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.223 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . 0.449 ' HB2' HD11 ' A' ' 79' ' ' LEU . 12.3 t-80 -148.19 112.97 5.41 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.812 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 56.39 36.74 28.02 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.396 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.43 -13.96 62.42 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.218 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -84.34 122.01 28.33 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.984 0.392 . . . . 0.0 110.812 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -105.38 146.03 29.99 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.135 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.57 138.51 24.76 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.136 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.2 mp -105.75 122.1 58.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.999 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.753 HD12 ' CD1' ' A' ' 8' ' ' PHE . 6.1 mt -126.27 127.45 70.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.923 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.3 140.76 29.38 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.315 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.481 ' CD2' HD12 ' A' ' 6' ' ' ILE . 8.0 m-85 -137.35 119.85 15.97 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.76 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.0 m -75.63 134.62 40.59 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.081 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.401 ' HA ' ' N ' ' A' ' 23' ' ' VAL . 7.3 mtm180 -75.77 150.42 83.98 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.226 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.06 120.76 7.33 Favored 'Cis proline' 0 C--N 1.349 0.577 0 C-N-CA 123.284 -1.549 . . . . 0.0 112.283 -0.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.401 ' N ' ' HA ' ' A' ' 21' ' ' ARG . 12.6 p -73.77 127.66 35.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.983 0.42 . . . . 0.0 110.993 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.97 130.57 46.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.945 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -55.87 -35.99 67.09 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.997 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.19 -44.49 96.49 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.152 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -66.26 -44.8 82.63 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.703 0.287 . . . . 0.0 111.006 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.1 t -67.16 -46.51 84.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.95 179.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -61.4 -42.51 98.84 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.304 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -58.16 -41.87 84.73 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.011 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.776 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -61.14 -46.98 88.31 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.881 179.602 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.0 t -66.25 -45.55 89.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.12 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.1 m -60.09 -38.71 83.74 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.1 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 59.7 m -70.61 -43.58 69.02 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 31' ' ' LYS . 62.1 t -58.47 -49.87 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-O 120.526 0.203 . . . . 0.0 111.311 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -83.7 -28.13 28.51 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.04 28.49 34.1 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.668 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.588 ' O ' HD12 ' A' ' 40' ' ' LEU . 8.9 pt20 -168.94 158.4 7.72 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-O 120.535 0.207 . . . . 0.0 110.899 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.03 124.7 10.79 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.943 2.429 . . . . 0.0 112.217 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.627 HD22 HD13 ' A' ' 79' ' ' LEU . 4.0 mp -117.21 151.54 36.68 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.175 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.25 120.99 40.75 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.928 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.633 HD23 HG21 ' A' ' 77' ' ' ILE . 4.0 mp -83.52 125.88 32.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.13 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -113.67 115.57 28.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -111.67 121.85 46.22 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.696 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -115.52 133.27 56.19 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.757 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -74.17 -56.18 5.21 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.77 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -170.04 -57.57 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.39 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.64 -30.32 10.04 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.316 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.6 mt -108.89 145.31 35.57 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.968 0.413 . . . . 0.0 111.389 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 30.2 t -109.78 127.98 55.0 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.952 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.9 mt -118.42 134.44 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.978 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.602 HD22 ' HG2' ' A' ' 54' ' ' LYS . 2.1 tt -90.69 128.98 36.83 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.841 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.569 HD12 ' HB3' ' A' ' 42' ' ' LEU . 47.5 mt -81.33 96.96 7.48 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.962 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.602 ' HG2' HD22 ' A' ' 52' ' ' LEU . 5.9 mmtp -108.72 -37.85 5.79 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.226 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -125.96 175.81 7.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.099 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.411 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 2.6 mt-30 -62.97 -32.63 74.01 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.904 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.25 -39.12 72.07 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.353 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.482 ' HB3' HD23 ' A' ' 53' ' ' LEU . 9.2 m-20 -64.16 -50.43 68.2 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.495 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.421 ' C ' HD12 ' A' ' 59' ' ' LEU . 3.6 pp -71.75 -34.45 69.51 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.086 -0.246 . . . . 0.0 110.926 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -63.01 -43.25 99.29 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.786 0.326 . . . . 0.0 111.027 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -33.26 73.71 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.91 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.96 99.69 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.257 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.639 ' HA ' HD12 ' A' ' 66' ' ' LEU . 16.0 mt -63.88 -42.58 96.31 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.737 179.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -54.35 -41.83 69.55 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.872 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 29.2 mt -66.7 -41.04 87.48 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.983 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.715 HD13 HD11 ' A' ' 75' ' ' LEU . 6.0 mt -65.19 -40.32 94.07 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.113 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -66.75 -32.02 73.04 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.171 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -33.77 76.57 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.48 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.7 t -104.76 134.22 48.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.452 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 94.3 p -77.33 -37.29 52.76 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.989 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.5 p -63.27 -35.85 81.7 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.135 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.07 121.49 27.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.698 0.285 . . . . 0.0 111.068 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -132.17 -52.61 0.96 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.996 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.2 m -70.01 177.94 2.95 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.134 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.715 HD11 HD13 ' A' ' 66' ' ' LEU . 1.1 mp -131.9 119.03 20.61 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.157 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -96.65 107.02 19.39 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.32 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.633 HG21 HD23 ' A' ' 42' ' ' LEU . 29.5 mt -128.69 132.19 67.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.904 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.6 mp -102.08 130.72 48.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.626 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.627 HD13 HD22 ' A' ' 40' ' ' LEU . 2.0 pp -117.86 136.05 53.7 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.958 0.409 . . . . 0.0 111.215 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mp -137.74 158.45 44.34 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.944 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.9 t . . . . . 0 C--O 1.233 0.207 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.099 179.885 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.242 0 CA-C-O 120.807 0.336 . . . . 0.0 111.236 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.407 ' O ' HD12 ' A' ' 6' ' ' ILE . 22.2 t -101.56 129.33 52.88 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.783 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -90.6 105.58 17.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.056 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.518 HD13 ' HD2' ' A' ' 19' ' ' PHE . 3.5 mp -114.99 129.07 71.8 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.208 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.4 mtpt -100.34 126.81 46.73 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.634 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.485 ' HB3' HD11 ' A' ' 79' ' ' LEU . 48.7 m-85 -114.89 127.56 55.77 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.022 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -122.0 131.2 53.87 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.217 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -145.5 128.73 16.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.694 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.73 30.67 20.25 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.221 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.96 -13.96 59.95 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.982 -0.628 . . . . 0.0 113.065 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.33 116.57 28.4 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 117.001 0.401 . . . . 0.0 110.848 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -104.93 135.87 45.48 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.233 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -134.2 154.27 51.35 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.248 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.413 ' O ' HD13 ' A' ' 17' ' ' ILE . 7.4 mt -115.31 122.25 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.344 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.413 HD13 ' O ' ' A' ' 16' ' ' ILE . 26.4 mm -127.49 128.66 70.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.145 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.91 129.05 36.32 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.694 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.518 ' HD2' HD13 ' A' ' 6' ' ' ILE . 11.9 m-85 -117.34 117.61 29.99 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.386 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.02 157.14 38.07 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.173 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.556 ' NH2' HG21 ' A' ' 63' ' ' ILE . 5.9 mmt180 -99.84 151.31 37.44 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.469 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.35 145.11 81.25 Favored 'Cis proline' 0 C--N 1.35 0.608 0 C-N-CA 123.414 -1.494 . . . . 0.0 112.801 0.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.6 p -107.42 124.49 63.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.106 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' O ' HG23 ' A' ' 28' ' ' VAL . 18.7 mmtm -102.56 149.88 23.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.236 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -58.11 -48.17 81.03 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.757 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.35 -42.28 95.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.227 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -62.08 -44.33 96.9 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.059 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' ' 24' ' ' LYS . 38.3 t -68.83 -48.72 69.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.785 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -40.06 84.62 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.2 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -58.18 -39.89 80.07 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.816 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -70.97 -41.03 71.57 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.752 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 28' ' ' VAL . 37.8 t -66.64 -42.58 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.186 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 t -65.71 -38.5 89.36 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.146 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.9 m -71.31 -46.79 59.85 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.436 HG13 ' N ' ' A' ' 36' ' ' PHE . 13.4 p -60.38 -47.95 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 -179.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.661 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 33.1 m-85 -84.08 -18.09 38.08 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.43 22.63 64.46 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 120.865 -0.683 . . . . 0.0 113.118 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.518 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -172.26 149.87 2.22 Favored Pre-proline 0 N--CA 1.463 0.216 0 CA-C-N 116.863 0.331 . . . . 0.0 110.94 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -74.23 106.9 2.32 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.569 2.179 . . . . 0.0 112.125 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.2 mp -104.87 140.04 38.73 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.96 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.47 140.75 41.36 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.017 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.661 ' HB2' HD12 ' A' ' 53' ' ' LEU . 3.3 mp -101.95 118.52 37.08 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.062 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -105.3 129.69 53.59 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.299 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -109.79 129.01 55.67 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.656 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.1 mtt -125.48 132.41 52.66 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.682 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -97.61 -65.83 0.94 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.686 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -144.87 -71.51 0.27 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.442 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -111.58 -18.23 12.86 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.527 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.3 mp -105.63 139.96 39.43 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.803 0.335 . . . . 0.0 111.35 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.8 m -114.03 125.8 54.4 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.828 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.1 mt -114.0 132.54 62.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.099 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.644 HD22 ' HE2' ' A' ' 54' ' ' LYS . 8.6 tt -92.38 128.08 38.1 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.8 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.834 HD13 HD21 ' A' ' 59' ' ' LEU . 71.9 mt -71.51 100.03 2.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.564 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.644 ' HE2' HD22 ' A' ' 52' ' ' LEU . 5.5 mmtt -90.2 -49.25 6.66 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.424 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -149.06 -170.2 3.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.869 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.69 -32.34 65.34 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.255 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -53.76 -45.66 70.69 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.849 0.357 . . . . 0.0 110.799 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.03 -42.69 84.43 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.166 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.834 HD21 HD13 ' A' ' 53' ' ' LEU . 77.5 mt -67.82 -40.53 83.78 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.272 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.776 ' HA ' HD12 ' A' ' 63' ' ' ILE . 3.0 t0 -61.66 -43.46 98.81 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.06 -179.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -63.39 -39.4 94.41 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.388 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.64 98.93 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.188 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.776 HD12 ' HA ' ' A' ' 60' ' ' ASP . 6.2 mt -63.78 -45.73 96.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.883 179.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -44.85 78.32 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.041 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.3 mt -67.09 -39.48 83.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.989 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.857 HD22 HD21 ' A' ' 75' ' ' LEU . 9.4 tp -61.99 -45.45 93.59 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.057 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -56.92 -37.24 71.2 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.256 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -33.24 64.62 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.101 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.3 t -89.07 92.68 9.31 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.256 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 40.6 t -62.99 -34.75 78.2 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.054 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.06 -33.78 67.6 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.318 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.96 129.42 42.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.097 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 47.5 mttt -111.71 -44.69 3.45 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.887 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.472 ' C ' HD22 ' A' ' 75' ' ' LEU . 60.5 p -101.62 179.04 4.46 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.187 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.857 HD21 HD22 ' A' ' 66' ' ' LEU . 4.0 mm? -123.25 128.93 50.68 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.062 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -88.47 108.57 19.45 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.654 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.9 mt -127.26 131.3 70.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.189 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -102.02 128.29 48.52 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.699 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.661 HD13 ' CZ ' ' A' ' 36' ' ' PHE . 2.5 mt -94.02 122.35 36.43 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.148 -179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.1 mp -134.1 134.24 42.04 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.114 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.233 0.186 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.996 -179.774 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 . . . . . 0 N--CA 1.469 0.509 0 CA-C-O 120.81 0.338 . . . . 0.0 111.342 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.4 t -99.59 131.58 46.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.208 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -88.96 119.93 29.92 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.746 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.5 mt -115.66 133.63 61.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.192 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.8 mttp -99.43 125.0 45.07 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.834 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -114.11 137.22 52.02 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.182 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.48 133.36 55.42 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.392 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -146.13 116.8 7.62 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.265 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 57.97 33.99 23.8 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.391 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.24 13.31 80.98 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 121.029 -0.605 . . . . 0.0 113.348 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -109.49 120.36 42.27 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 117.237 0.519 . . . . 0.0 110.518 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -92.75 135.21 34.31 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.978 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.38 143.39 50.74 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.036 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.422 ' O ' HD13 ' A' ' 17' ' ' ILE . 3.6 mt -110.12 116.02 51.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.199 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.422 HD13 ' O ' ' A' ' 16' ' ' ILE . 26.3 mm -128.36 131.46 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.046 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.47 129.88 36.59 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.007 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -127.15 118.38 24.23 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.934 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.95 145.08 34.21 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.972 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -99.85 149.56 36.06 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.171 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.77 121.65 7.95 Favored 'Cis proline' 0 C--N 1.35 0.655 0 C-N-CA 123.361 -1.516 . . . . 0.0 112.899 0.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.7 p -89.86 130.48 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.855 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -84.09 138.25 33.14 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.126 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -55.99 -45.04 79.13 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.234 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.57 -39.62 80.82 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.938 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -63.4 -44.59 94.24 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.047 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 32' ' ' VAL . 21.5 t -67.87 -48.88 73.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.016 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -41.18 96.08 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.503 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -45.39 87.38 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.766 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.651 ' O ' HG23 ' A' ' 35' ' ' VAL . 1.4 tptm -61.59 -47.58 84.84 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.769 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.58 HG11 HD22 ' A' ' 79' ' ' LEU . 39.1 t -58.93 -48.9 84.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-O 120.668 0.271 . . . . 0.0 110.964 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.4 m -64.28 -39.03 93.11 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.472 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.3 m -71.82 -48.19 48.01 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 31' ' ' LYS . 65.5 t -60.85 -48.83 87.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 -179.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.439 ' CE2' HD13 ' A' ' 79' ' ' LEU . 52.5 m-85 -83.28 -22.09 33.11 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.67 -7.73 81.13 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.887 -0.673 . . . . 0.0 113.34 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.669 ' O ' HD12 ' A' ' 40' ' ' LEU . 16.1 mt-30 -131.67 145.57 58.09 Favored Pre-proline 0 CA--C 1.529 0.152 0 CA-C-N 117.279 0.539 . . . . 0.0 110.984 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -75.06 94.4 0.96 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.57 2.18 . . . . 0.0 112.211 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.669 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.6 mp -94.68 135.98 35.52 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.888 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.577 ' CG ' HD11 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -76.16 140.47 41.75 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.962 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 mt -87.3 100.19 12.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.596 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.521 ' CE1' HD13 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -95.44 117.76 30.95 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.497 -179.382 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -107.07 115.94 31.06 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.361 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.4 ptm -101.3 134.88 43.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.77 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -89.62 -45.46 9.34 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.87 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -173.16 -68.36 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.43 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -108.99 -24.5 11.18 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.505 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 mp -105.03 137.94 42.0 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.789 0.328 . . . . 0.0 111.302 -179.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 p -95.62 124.42 39.64 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.596 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.7 134.37 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.735 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.577 HD11 ' CG ' ' A' ' 41' ' ' ASP . 14.0 tp -102.74 130.84 49.82 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.743 0.306 . . . . 0.0 110.957 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.467 HD21 ' HA ' ' A' ' 59' ' ' LEU . 8.1 mt -78.07 93.35 4.49 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.852 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.15 -37.46 12.1 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.155 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -134.83 171.55 14.22 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.835 0.35 . . . . 0.0 111.337 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.1 tp60 -60.72 -31.61 70.9 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.363 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -52.97 -45.86 67.99 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.773 0.321 . . . . 0.0 110.506 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.439 ' HB3' HD23 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -63.16 -39.47 94.76 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.239 179.591 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.467 ' HA ' HD21 ' A' ' 53' ' ' LEU . 17.7 tp -66.29 -42.98 87.58 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.143 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.596 ' HA ' HD12 ' A' ' 63' ' ' ILE . 3.3 m-20 -61.49 -43.12 99.43 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.836 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.66 -40.63 97.68 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.469 179.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.42 -42.93 99.81 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.666 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.596 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.7 mt -63.3 -44.17 99.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 120.521 0.2 . . . . 0.0 110.834 179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -55.79 -43.73 77.1 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.253 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.6 mt -68.87 -41.74 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.933 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.478 HD13 ' HG ' ' A' ' 75' ' ' LEU . 1.5 tp -60.68 -45.05 95.64 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.012 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -58.62 -41.74 86.63 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.996 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.0 ttp85 -71.29 -33.57 69.84 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.611 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.2 p -82.57 103.03 11.8 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.847 0.356 . . . . 0.0 111.284 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 59.8 m -77.91 -38.2 46.2 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.281 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 p -61.96 -33.22 73.88 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.607 0.241 . . . . 0.0 111.562 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.0 tpt -63.17 150.29 43.27 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.99 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.34 105.25 8.41 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.705 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.9 m 66.04 -178.56 0.19 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.097 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.478 ' HG ' HD13 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -98.84 123.42 43.08 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.95 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.33 107.14 18.99 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.835 0.35 . . . . 0.0 110.633 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.6 mt -128.1 131.16 69.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.805 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -102.0 124.65 47.98 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.555 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.58 HD22 HG11 ' A' ' 32' ' ' VAL . 14.5 mt -93.63 133.28 37.13 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.211 -179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.439 HD21 ' ND1' ' A' ' 43' ' ' HIS . 0.4 OUTLIER -140.21 136.16 33.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.367 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.466 0.371 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.492 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 . . . . . 0 N--CA 1.468 0.449 0 CA-C-O 120.886 0.374 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -87.18 135.31 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.263 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.2 mtm-85 -92.93 124.5 36.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.913 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.508 HD12 ' HD1' ' A' ' 19' ' ' PHE . 2.8 mt -113.62 136.79 48.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.151 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -95.65 119.74 34.69 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.864 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.676 ' CD2' HD21 ' A' ' 79' ' ' LEU . 20.5 m-85 -107.71 136.69 47.03 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.907 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -127.42 132.1 50.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.826 0.346 . . . . 0.0 111.551 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.7 t-160 -144.58 123.89 13.03 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.55 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 57.5 35.09 25.46 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.062 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 84.01 -14.19 45.06 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.464 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.83 149.26 37.91 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 117.193 0.497 . . . . 0.0 111.198 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -110.44 135.17 51.55 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.058 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -140.8 143.03 34.61 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.739 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.0 mt -118.06 118.13 57.16 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.996 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.4 mp -126.65 127.02 69.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.242 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.9 146.44 23.75 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.118 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.508 ' HD1' HD12 ' A' ' 6' ' ' ILE . 53.8 m-85 -135.27 134.66 40.18 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.064 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -81.72 125.77 31.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.906 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 ptt180 -93.46 153.46 41.37 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.059 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.1 119.62 6.32 Favored 'Cis proline' 0 C--N 1.351 0.703 0 C-N-CA 123.429 -1.488 . . . . 0.0 112.838 0.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -99.88 130.44 48.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.017 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.6 143.12 31.24 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.779 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -57.1 -36.17 70.31 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.926 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -59.18 -44.76 92.17 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.717 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.72 -40.39 95.25 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.9 t -67.8 -49.01 73.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.114 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -59.32 -39.79 84.23 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.927 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -40.71 89.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.823 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.731 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -66.04 -48.21 71.83 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.223 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 44.1 t -59.69 -43.62 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.245 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.6 m -60.66 -38.98 86.66 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.951 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.7 m -71.76 -44.45 64.03 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 111.461 0.171 . . . . 0.0 111.461 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 31' ' ' LYS . 34.5 t -59.52 -50.18 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-O 120.49 0.186 . . . . 0.0 111.444 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.513 ' CE2' HD13 ' A' ' 79' ' ' LEU . 34.1 m-85 -83.71 -26.57 29.67 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -179.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.24 -11.13 61.84 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.926 -0.654 . . . . 0.0 113.145 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.451 ' O ' HD12 ' A' ' 40' ' ' LEU . 1.6 mp0 -141.54 156.96 66.46 Favored Pre-proline 0 N--CA 1.465 0.283 0 CA-C-N 116.978 0.389 . . . . 0.0 110.702 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.401 ' HD2' ' HB3' ' A' ' 38' ' ' GLN . 56.6 Cg_endo -71.16 111.68 3.13 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.586 2.191 . . . . 0.0 112.524 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.451 HD12 ' O ' ' A' ' 38' ' ' GLN . 6.4 mp -101.68 157.92 16.48 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -99.89 138.05 37.5 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.968 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.601 HD23 HG21 ' A' ' 77' ' ' ILE . 3.7 mp -91.79 112.63 24.63 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.994 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -103.05 111.81 24.34 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.117 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.549 ' HE2' HD12 ' A' ' 75' ' ' LEU . 13.6 t80 -104.35 117.44 34.19 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.591 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 6.4 mtp -123.49 126.53 46.9 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.824 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -74.0 -59.59 2.65 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.43 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -170.22 -54.75 0.02 OUTLIER 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.431 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -104.32 -31.82 9.37 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.498 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.5 mp -108.76 144.25 36.83 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.79 0.328 . . . . 0.0 111.329 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.2 m -113.59 123.48 50.07 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.994 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -114.53 133.35 60.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.916 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.0 tt -93.65 124.73 37.84 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.982 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.83 HD23 ' HB3' ' A' ' 58' ' ' ASP . 4.2 mt -75.89 94.44 3.35 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.454 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -85.47 -34.31 21.65 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.416 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -160.51 -169.83 2.58 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.776 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -61.2 -29.82 70.04 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.493 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.95 -47.08 68.37 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.795 0.331 . . . . 0.0 110.725 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.83 ' HB3' HD23 ' A' ' 53' ' ' LEU . 1.7 t70 -67.64 -40.47 84.59 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.004 179.441 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 tp -66.8 -37.47 84.61 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.277 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.834 ' HA ' HD12 ' A' ' 63' ' ' ILE . 4.5 t70 -61.18 -42.79 99.19 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.12 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.92 -35.64 80.46 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.613 179.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -37.36 86.84 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.055 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.834 HD12 ' HA ' ' A' ' 60' ' ' ASP . 7.9 mt -63.83 -40.76 90.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.956 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -53.31 -45.39 68.96 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.864 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.7 mt -69.04 -36.38 73.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.115 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.941 HD22 HD21 ' A' ' 75' ' ' LEU . 22.1 tp -68.91 -41.98 77.48 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.87 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -62.42 -42.39 99.41 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.218 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.2 ptm85 -71.66 -30.46 65.75 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.553 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.7 p -88.99 108.95 19.86 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.892 0.377 . . . . 0.0 111.052 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.2 m -76.07 -34.61 59.57 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.23 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 81.5 p -63.81 -35.0 79.18 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.348 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.8 tpp -84.54 158.67 20.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.959 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.3 tttt -145.6 -54.8 0.29 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.084 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . 0.51 ' C ' HD22 ' A' ' 75' ' ' LEU . 78.7 p -93.08 173.9 7.5 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.827 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.941 HD21 HD22 ' A' ' 66' ' ' LEU . 3.8 mm? -122.88 131.04 53.57 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.991 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.427 ' O ' HD13 ' A' ' 77' ' ' ILE . 11.2 mtm180 -86.55 109.21 18.96 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.984 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.601 HG21 HD23 ' A' ' 42' ' ' LEU . 17.4 mm -124.88 132.38 71.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.088 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.632 HD23 HD11 ' A' ' 80' ' ' LEU . 3.5 tp -101.97 131.52 48.33 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.554 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.676 HD21 ' CD2' ' A' ' 8' ' ' PHE . 1.3 mt -102.19 119.68 39.2 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.051 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.632 HD11 HD23 ' A' ' 78' ' ' LEU . 2.2 mp -141.3 145.39 35.44 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.678 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.4 t . . . . . 0 C--O 1.234 0.239 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.951 179.934 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.41 ' HA ' ' HA ' ' A' ' 20' ' ' SER . 8.4 t0 . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.884 0.373 . . . . 0.0 110.597 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.7 t -99.97 127.37 52.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.959 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.92 121.76 29.85 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.891 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.538 HD12 ' CD2' ' A' ' 19' ' ' PHE . 31.1 mt -111.61 130.08 65.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.965 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -103.72 113.3 26.72 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.734 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.674 ' HB3' HD11 ' A' ' 79' ' ' LEU . 64.5 m-85 -97.14 143.95 27.45 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.088 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -135.59 127.55 29.55 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.197 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -147.85 118.14 7.35 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.552 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 58.74 35.31 24.3 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.095 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.01 6.79 89.22 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 120.949 -0.643 . . . . 0.0 113.249 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -100.59 111.09 23.29 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 117.162 0.481 . . . . 0.0 110.792 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.3 ptt85 -94.64 141.66 28.35 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.197 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.4 mtt85 -143.72 141.24 30.39 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.054 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 21.8 mt -112.62 128.0 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.185 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.113 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.7 mp -134.07 137.82 51.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.226 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.8 135.85 33.45 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.073 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.538 ' CD2' HD12 ' A' ' 6' ' ' ILE . 75.0 m-85 -135.67 116.84 14.44 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.148 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' ASP . 0.3 OUTLIER -93.14 135.24 34.51 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.975 179.692 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mtt180 -78.55 155.73 78.52 Favored Pre-proline 0 N--CA 1.463 0.193 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.933 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.93 125.56 11.46 Favored 'Cis proline' 0 C--N 1.35 0.64 0 C-N-CA 123.406 -1.498 . . . . 0.0 112.494 -0.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.0 p -108.04 128.5 63.37 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.004 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.4 mttt -92.83 143.22 26.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.166 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.401 ' HB2' ' HG2' ' A' ' 56' ' ' GLN . 72.4 t80 -56.48 -39.44 73.23 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.833 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -64.73 -39.38 93.54 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.937 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -44.19 96.94 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.935 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.66 ' O ' HG23 ' A' ' 32' ' ' VAL . 21.9 t -68.73 -48.04 73.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.051 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -59.99 -40.04 87.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.145 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.48 -39.99 81.49 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.665 179.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.702 ' O ' HG23 ' A' ' 35' ' ' VAL . 14.8 tttt -69.13 -46.56 67.34 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.45 179.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 28' ' ' VAL . 18.0 t -59.76 -48.52 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.399 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -60.77 -38.46 85.33 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.491 -179.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 60.8 m -69.83 -45.39 67.93 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.682 0.252 . . . . 0.0 111.682 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.9 t -60.02 -49.27 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.492 0.186 . . . . 0.0 111.352 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.715 ' CE2' HD13 ' A' ' 79' ' ' LEU . 27.1 m-85 -80.96 -23.6 38.67 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.722 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.2 19.64 76.65 Favored Glycine 0 CA--C 1.523 0.574 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.908 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.485 ' O ' HD12 ' A' ' 40' ' ' LEU . 13.1 mt-30 -155.92 148.36 17.74 Favored Pre-proline 0 C--O 1.233 0.217 0 CA-C-N 116.792 0.296 . . . . 0.0 111.005 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.35 104.29 1.83 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.701 2.267 . . . . 0.0 112.325 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.485 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.2 mp -109.23 138.32 45.77 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.059 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -81.22 138.42 35.79 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.064 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.2 mp -90.61 120.66 31.86 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.871 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -108.27 116.76 32.56 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.235 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.535 ' HB2' HD11 ' A' ' 53' ' ' LEU . 17.7 t80 -110.32 120.36 42.17 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.83 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -130.44 135.58 48.14 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.831 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -77.4 -62.55 1.62 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.863 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.85 -53.69 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.366 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -104.5 -32.46 8.97 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.417 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.427 HD13 ' H ' ' A' ' 50' ' ' SER . 0.1 OUTLIER -106.49 137.32 44.69 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.692 0.282 . . . . 0.0 111.236 -179.725 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.427 ' H ' HD13 ' A' ' 49' ' ' LEU . 15.7 m -113.82 130.4 56.47 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.841 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.4 mt -124.01 133.01 70.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.195 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.2 tt -89.68 131.33 35.71 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.821 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.535 HD11 ' HB2' ' A' ' 44' ' ' TYR . 7.3 mt -87.58 103.85 15.95 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.896 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -109.12 -36.55 6.03 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.025 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -128.05 174.48 9.18 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.171 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.401 ' HG2' ' HB2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -62.56 -32.48 73.45 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.074 179.813 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -54.12 -41.54 68.45 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.034 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.518 ' HB3' HD23 ' A' ' 53' ' ' LEU . 7.8 m-20 -63.39 -47.5 81.79 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.012 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.06 -40.16 90.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.89 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.58 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.9 OUTLIER -62.05 -42.97 99.75 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.731 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.57 -33.39 74.92 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.961 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.44 -37.21 84.98 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.275 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.58 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.8 mt -65.77 -43.91 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.645 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.16 -45.36 91.21 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.079 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 26.3 mt -68.26 -41.42 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.091 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.2 tp -68.74 -39.81 80.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.165 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -62.48 -41.89 99.1 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.653 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.6 ptt180 -67.7 -26.99 66.45 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.622 0.249 . . . . 0.0 110.958 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.1 t -70.34 127.33 32.38 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.716 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.1 m -60.82 -37.08 80.77 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.421 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -65.57 0.66 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.196 -179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 9.9 ptt? 37.94 66.36 0.48 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.437 0.46 . . . . 0.0 111.846 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm -110.05 89.32 2.99 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.6 m 63.32 170.34 0.15 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.637 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.8 mp -110.33 122.69 48.29 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.102 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.63 107.44 19.43 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.648 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.9 mt -129.67 131.36 66.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.87 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.1 tp -101.9 126.87 48.89 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.617 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.715 HD13 ' CE2' ' A' ' 36' ' ' PHE . 3.5 mt -93.56 134.38 35.91 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.005 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 pp -150.95 144.09 24.72 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.987 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.2 m . . . . . 0 C--O 1.233 0.205 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.124 -179.919 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.403 0 CA-C-O 120.985 0.421 . . . . 0.0 111.483 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.1 t -139.85 123.51 18.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.204 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.2 108.39 19.27 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.571 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.486 HD12 ' CD2' ' A' ' 19' ' ' PHE . 22.8 mt -108.43 125.07 65.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.97 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -95.63 120.36 35.73 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.658 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.661 ' HD2' HD12 ' A' ' 17' ' ' ILE . 61.0 m-85 -113.1 127.41 56.19 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.66 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 14' ' ' ARG . 4.5 pt-20 -123.35 139.86 53.6 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.948 0.404 . . . . 0.0 111.429 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -137.89 114.44 10.41 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.451 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 61.22 38.14 16.89 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.125 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.09 -14.33 59.26 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.332 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.41 105.98 17.95 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 117.073 0.436 . . . . 0.0 110.783 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.403 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -91.44 156.23 17.87 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.073 -179.958 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.1 157.92 43.77 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.046 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.5 mt -114.64 120.29 63.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.661 HD12 ' HD2' ' A' ' 8' ' ' PHE . 11.7 mt -130.71 126.92 61.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.732 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.09 146.51 24.26 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.212 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.486 ' CD2' HD12 ' A' ' 6' ' ' ILE . 29.4 m-85 -138.46 132.84 31.93 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.049 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 p -81.36 165.9 20.93 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.201 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -110.25 143.87 28.95 Favored Pre-proline 0 CA--C 1.529 0.159 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.13 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.52 136.0 41.27 Favored 'Cis proline' 0 C--N 1.35 0.634 0 C-N-CA 123.362 -1.516 . . . . 0.0 112.576 -0.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.0 p -88.77 129.43 39.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.031 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.469 ' O ' HG23 ' A' ' 28' ' ' VAL . 71.2 mmtt -100.49 130.71 46.6 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -54.73 -45.26 74.09 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.113 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -58.76 -42.44 88.91 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.049 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -62.88 -44.26 96.57 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.005 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 24' ' ' LYS . 24.5 t -64.69 -48.24 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.874 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.09 -36.48 81.83 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.014 179.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -58.36 -36.91 74.18 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.13 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.678 ' O ' HG23 ' A' ' 35' ' ' VAL . 3.8 mttt -72.91 -47.92 41.62 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.669 0.271 . . . . 0.0 110.523 179.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.73 -45.43 94.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.264 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -61.67 -38.62 88.43 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.444 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -71.4 -44.29 65.19 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.678 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.0 t -60.67 -50.26 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -179.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -83.82 -24.78 30.82 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.53 24.81 32.25 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.913 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.619 ' O ' HD12 ' A' ' 40' ' ' LEU . 14.1 pt20 -177.43 147.58 0.67 Allowed Pre-proline 0 N--CA 1.465 0.296 0 CA-C-N 116.638 0.219 . . . . 0.0 110.611 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.83 108.4 2.56 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.397 2.065 . . . . 0.0 112.0 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.68 HD22 ' CD1' ' A' ' 79' ' ' LEU . 5.1 mp -89.79 140.8 29.24 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.088 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -75.83 120.34 21.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.013 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.508 HD23 ' HB3' ' A' ' 79' ' ' LEU . 67.6 mt -86.71 122.9 31.25 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.449 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -112.89 124.4 52.53 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.111 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.441 ' CD2' HD11 ' A' ' 75' ' ' LEU . 11.7 t80 -108.51 129.01 55.3 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.554 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 6.1 mtt -117.44 127.02 53.61 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.726 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -86.56 -51.93 5.86 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.719 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -173.54 -63.12 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.422 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.61 -27.52 11.3 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.489 179.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.13 153.2 26.06 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.901 0.381 . . . . 0.0 111.31 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.4 t -117.22 128.69 55.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.768 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.8 mm -113.85 133.44 59.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.611 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.473 HD23 ' N ' ' A' ' 53' ' ' LEU . 6.8 tt -95.79 130.06 42.83 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.172 -179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.473 ' N ' HD23 ' A' ' 52' ' ' LEU . 1.2 mt -81.95 107.88 15.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.987 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -38.65 4.67 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.408 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -131.67 -179.39 5.35 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.091 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -64.63 -30.19 71.2 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.816 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -57.91 -39.32 77.65 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.583 0.23 . . . . 0.0 110.928 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -68.46 -43.28 77.34 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.832 0.348 . . . . 0.0 110.488 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.56 -44.78 95.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.933 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.23 -41.46 98.43 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.7 mtpm? -66.15 -36.74 83.92 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.217 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.9 -41.48 99.44 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.599 0.238 . . . . 0.0 111.522 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 11.8 mt -66.12 -43.25 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.587 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.9 -42.7 76.41 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.177 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 14.7 mt -66.43 -42.16 89.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.042 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.625 HD22 HD23 ' A' ' 75' ' ' LEU . 15.8 tp -59.78 -44.58 93.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.887 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.54 -35.96 70.99 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.902 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.2 ttt-85 -70.61 -35.12 72.82 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.298 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.5 t -86.49 94.19 9.36 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.718 0.294 . . . . 0.0 111.048 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 91.2 p -58.79 -36.98 75.33 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.145 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.2 p -60.35 -33.68 72.76 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.389 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.0 mtt -85.88 123.7 31.53 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.187 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.91 -33.95 7.78 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.233 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -116.65 156.46 27.02 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.583 0.23 . . . . 0.0 110.962 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.625 HD23 HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -91.88 129.35 37.87 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.662 179.817 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.404 ' N ' HD13 ' A' ' 75' ' ' LEU . 0.0 OUTLIER -97.17 107.82 20.42 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.048 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.574 ' CG1' HD12 ' A' ' 75' ' ' LEU . 2.9 mp -128.08 132.16 68.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.956 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.7 tp -102.51 118.29 36.54 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.912 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.68 ' CD1' HD22 ' A' ' 40' ' ' LEU . 2.7 pp -110.96 135.41 51.52 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.949 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.447 ' C ' HD23 ' A' ' 40' ' ' LEU . 1.1 mp -137.54 148.05 45.64 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.162 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 m . . . . . 0 C--O 1.233 0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.696 179.713 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 . . . . . 0 N--CA 1.466 0.353 0 CA-C-O 120.867 0.365 . . . . 0.0 111.273 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.1 t -87.48 127.81 40.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.245 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -98.54 106.87 19.2 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.685 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.531 ' CG2' HD12 ' A' ' 77' ' ' ILE . 4.0 mp -109.19 133.77 53.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.307 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.82 105.13 13.86 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.546 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.747 ' HB3' HD11 ' A' ' 79' ' ' LEU . 45.6 m-85 -93.17 148.52 21.95 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.15 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -135.7 125.08 24.84 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.982 0.42 . . . . 0.0 111.153 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.2 t-160 -142.16 129.45 21.1 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.514 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.45 29.44 19.01 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.29 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 86.79 -14.1 57.17 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 120.875 -0.679 . . . . 0.0 113.304 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -91.67 132.04 36.64 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 117.078 0.439 . . . . 0.0 110.903 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -101.9 147.7 26.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.184 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -137.1 141.28 42.33 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.969 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.8 mt -111.72 120.76 62.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.125 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.5 mt -133.3 132.74 58.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.141 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.31 141.65 33.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.164 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -123.77 134.94 53.57 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.342 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.6 m -87.47 134.85 33.54 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.142 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.51 149.23 74.81 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.968 179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.22 121.99 8.28 Favored 'Cis proline' 0 C--N 1.35 0.651 0 C-N-CA 123.312 -1.537 . . . . 0.0 112.5 -0.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.421 HG13 ' O ' ' A' ' 23' ' ' VAL . 14.0 p -83.04 119.63 32.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.785 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.434 ' O ' HG23 ' A' ' 28' ' ' VAL . 7.0 mmmt -98.74 143.79 28.7 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.946 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -54.63 -41.41 69.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.001 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.84 -44.48 96.9 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.76 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -62.63 -44.2 96.88 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.259 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 24' ' ' LYS . 22.5 t -67.25 -48.4 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.105 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.04 -39.05 77.45 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.811 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -58.92 -45.8 89.49 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.836 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.678 ' O ' HG23 ' A' ' 35' ' ' VAL . 3.7 mmtt -61.11 -47.88 84.26 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.946 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.2 t -59.0 -46.83 91.42 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.725 0.298 . . . . 0.0 110.849 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.513 HG23 ' N ' ' A' ' 39' ' ' PRO . 22.5 m -61.54 -40.16 93.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.287 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 58.9 m -71.73 -46.22 59.28 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.678 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.1 t -62.79 -50.1 81.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 121.224 -0.19 . . . . 0.0 111.495 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.545 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 85.6 m-85 -83.86 -19.39 34.94 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.306 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.88 -20.42 49.95 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.958 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.501 ' O ' HD12 ' A' ' 40' ' ' LEU . 18.0 mt-30 -134.81 147.36 62.65 Favored Pre-proline 0 N--CA 1.462 0.141 0 CA-C-N 116.816 0.308 . . . . 0.0 110.387 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.513 ' N ' HG23 ' A' ' 33' ' ' THR . 57.6 Cg_endo -72.79 99.25 1.05 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.395 2.063 . . . . 0.0 112.269 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.501 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.2 mp -87.82 156.8 19.22 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.026 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -91.12 140.28 29.97 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.975 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.64 107.47 19.23 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.99 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 113.9 27.7 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.994 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.414 ' CD2' HG12 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -91.68 129.15 37.7 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.219 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -125.35 118.23 25.46 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.951 0.405 . . . . 0.0 110.707 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -88.86 -71.47 0.59 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.049 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -136.19 -72.11 0.45 Allowed 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.37 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -120.9 19.44 11.72 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.127 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.72 147.46 52.51 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.766 0.317 . . . . 0.0 111.134 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.0 p -119.17 126.66 52.09 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.58 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mp -113.62 131.53 65.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.626 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -107.29 121.36 44.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.255 -179.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.6 mt -77.3 95.53 4.38 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.565 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.08 -34.85 11.57 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.134 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -138.24 173.18 11.89 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.847 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -59.26 -34.71 72.57 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.219 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -53.88 -41.14 67.22 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.916 0.389 . . . . 0.0 110.736 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -39.77 94.87 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.011 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 tp -65.35 -43.27 91.39 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.886 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.85 -41.55 97.97 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.797 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -65.21 -36.73 85.1 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.957 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.47 -39.17 92.55 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.499 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 25.4 mt -64.23 -43.18 97.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.751 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.43 -39.27 70.05 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.187 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.8 mt -67.32 -44.62 87.16 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.133 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.572 HD13 ' HG ' ' A' ' 75' ' ' LEU . 1.0 OUTLIER -59.63 -47.24 86.38 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.537 -0.302 . . . . 0.0 110.683 179.933 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -64.26 -37.39 87.31 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.7 -33.03 74.95 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.2 179.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.1 t -67.02 136.24 54.97 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.83 0.348 . . . . 0.0 111.252 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 18.2 m -74.77 -25.75 59.28 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.501 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.1 t -134.4 82.35 1.96 Allowed 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.06 0.457 . . . . 0.0 110.578 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 30.7 tpp -158.25 105.44 1.91 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.596 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -102.82 -63.15 1.19 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.028 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.8 t -82.0 158.17 23.94 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.181 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.572 ' HG ' HD13 ' A' ' 66' ' ' LEU . 7.2 mp -101.15 125.22 47.76 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.102 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 107.38 19.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.662 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.531 HD12 ' CG2' ' A' ' 6' ' ' ILE . 22.1 mt -129.44 131.77 67.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.829 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.82 132.32 47.65 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.636 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.747 HD11 ' HB3' ' A' ' 8' ' ' PHE . 10.0 mt -93.66 128.81 40.02 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.174 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.9 mt -133.96 136.24 44.04 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.463 0.184 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.767 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 . . . . . 0 N--CA 1.468 0.461 0 CA-C-O 120.789 0.328 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.8 t -97.78 135.96 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.328 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.0 114.37 23.55 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.113 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.53 ' CG2' HD12 ' A' ' 77' ' ' ILE . 31.0 mm -109.06 119.75 59.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.901 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.41 114.46 26.23 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.746 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . 0.473 ' CD2' HD12 ' A' ' 17' ' ' ILE . 51.8 m-85 -100.37 140.32 34.79 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.184 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.72 124.74 20.03 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.124 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -138.89 112.04 7.99 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.575 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 58.46 36.3 25.24 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.353 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.69 -14.27 61.98 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.886 -0.674 . . . . 0.0 113.096 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.8 104.55 11.39 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.957 0.379 . . . . 0.0 110.622 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptp85 -92.3 136.85 32.86 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.189 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.434 ' HD3' HD11 ' A' ' 17' ' ' ILE . 16.0 ttt85 -137.06 143.53 42.68 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.162 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.93 120.71 61.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.864 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.473 HD12 ' CD2' ' A' ' 8' ' ' PHE . 27.8 mt -134.72 132.55 54.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.168 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.59 143.83 25.94 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.128 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.506 ' CE2' HG22 ' A' ' 28' ' ' VAL . 6.9 m-85 -129.99 121.14 25.94 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.282 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -76.11 129.41 36.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.838 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -70.25 150.73 95.94 Favored Pre-proline 0 N--CA 1.463 0.212 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.086 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -75.24 134.13 34.52 Favored 'Cis proline' 0 C--N 1.35 0.651 0 C-N-CA 123.705 -1.373 . . . . 0.0 112.472 0.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 23' ' ' VAL . 11.6 p -84.12 118.32 31.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-O 120.944 0.402 . . . . 0.0 110.792 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 28' ' ' VAL . 20.3 mmtm -101.1 129.94 47.07 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.862 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.631 ' CE1' HD12 ' A' ' 42' ' ' LEU . 54.0 t80 -55.55 -45.16 77.28 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.952 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -60.1 -42.32 94.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.053 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.49 -44.07 97.27 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.036 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.562 ' O ' HG23 ' A' ' 32' ' ' VAL . 23.3 t -66.75 -48.0 81.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.577 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.8 -41.59 87.12 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.207 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -57.31 -45.36 84.28 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.877 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.74 ' O ' HG23 ' A' ' 35' ' ' VAL . 3.4 tttm -66.54 -47.83 71.65 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.691 -0.232 . . . . 0.0 110.989 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 28' ' ' VAL . 45.8 t -58.34 -43.67 86.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.711 0.291 . . . . 0.0 110.982 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 97.2 m -62.84 -38.92 92.7 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.905 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.6 m -71.68 -45.61 61.39 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.384 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.74 HG23 ' O ' ' A' ' 31' ' ' LYS . 40.9 t -58.88 -49.69 82.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 120.524 0.202 . . . . 0.0 111.509 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -83.4 -26.91 29.99 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.76 25.54 32.1 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.954 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.556 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -169.97 145.67 2.48 Favored Pre-proline 0 N--CA 1.464 0.265 0 CA-C-N 116.871 0.335 . . . . 0.0 110.96 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.52 103.52 1.56 Allowed 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.586 2.191 . . . . 0.0 112.394 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.556 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.9 mp -96.26 154.92 16.99 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.107 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -88.72 140.97 28.9 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.997 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.631 HD12 ' CE1' ' A' ' 25' ' ' TYR . 67.5 mt -100.71 124.05 45.78 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.606 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.486 ' ND1' HD21 ' A' ' 80' ' ' LEU . 6.3 m80 -117.0 129.32 55.95 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.162 -179.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.404 ' CD2' ' HB1' ' A' ' 62' ' ' ALA . 19.2 t80 -114.32 129.69 56.65 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.763 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.4 mtm -111.31 113.36 25.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.542 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.9 p-10 -67.17 -52.59 39.46 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.282 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -148.84 -73.9 0.18 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.331 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -119.67 14.13 12.58 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.336 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.48 148.72 52.66 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.66 0.267 . . . . 0.0 111.164 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.4 m -112.21 128.76 56.34 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.112 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.7 mp -115.96 132.1 66.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.925 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -81.88 134.31 35.39 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.706 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp -102.65 104.03 14.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.059 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.43 -35.92 6.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.358 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -120.17 170.83 8.95 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.771 0.319 . . . . 0.0 111.051 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.48 -35.51 77.87 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.03 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -55.07 -41.16 71.16 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.069 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -64.03 -47.25 80.97 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.68 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.487 HD13 ' HD1' ' A' ' 25' ' ' TYR . 5.0 tp -63.17 -41.88 99.3 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.149 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -43.07 99.81 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.01 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -34.07 77.23 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.132 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.404 ' HB1' ' CD2' ' A' ' 44' ' ' TYR . . . -62.57 -35.34 79.19 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.275 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.598 ' CD1' HD11 ' A' ' 75' ' ' LEU . 29.8 mm -64.24 -44.56 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.627 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -40.88 71.82 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.118 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 37.1 mm -63.34 -45.14 98.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.912 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 tp -62.8 -44.66 95.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.719 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -64.32 -34.7 78.75 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.274 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -32.13 71.73 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.054 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -70.9 154.15 42.07 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.047 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.3 p -76.22 -33.66 59.23 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.362 179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.7 p -70.66 -76.01 0.11 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.525 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.2 ttt 53.33 82.8 0.07 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.849 0.357 . . . . 0.0 111.217 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.85 -39.69 3.24 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.94 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.3 t -155.76 162.67 40.47 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.533 0.206 . . . . 0.0 110.946 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.598 HD11 ' CD1' ' A' ' 63' ' ' ILE . 0.3 OUTLIER -94.43 128.22 40.84 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.088 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.84 109.6 20.93 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.97 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.53 HD12 ' CG2' ' A' ' 6' ' ' ILE . 32.7 mt -128.79 128.64 67.84 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.925 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.99 131.3 48.49 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.741 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.425 HD23 ' CD2' ' A' ' 42' ' ' LEU . 2.3 mt -100.56 133.05 45.58 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.039 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.486 HD21 ' ND1' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -156.57 135.71 12.01 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.83 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.464 0.271 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.88 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.1 p -149.82 78.09 1.34 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.871 0.367 . . . . 0.0 111.044 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.2 p-10 -169.83 80.34 0.11 Allowed 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.073 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.0 t -82.07 134.81 26.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.799 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.2 ttm105 -97.97 113.01 24.73 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.531 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.534 HG23 ' HB2' ' A' ' 75' ' ' LEU . 4.0 mp -114.61 134.09 58.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.185 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.6 mttt -104.33 114.66 29.04 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.878 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.689 ' CD2' HD12 ' A' ' 17' ' ' ILE . 79.4 m-85 -102.52 143.45 32.2 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.153 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.422 ' HG3' ' HG3' ' A' ' 14' ' ' ARG . 36.7 tt0 -133.01 129.51 38.25 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.344 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -139.24 115.1 10.12 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.518 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.02 34.28 23.44 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.234 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.44 -14.24 61.71 Favored Glycine 0 CA--C 1.525 0.691 0 C-N-CA 120.995 -0.622 . . . . 0.0 113.253 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -85.06 119.43 25.44 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.996 0.398 . . . . 0.0 110.641 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.422 ' HG3' ' HG3' ' A' ' 9' ' ' GLU . 2.7 mpt_? -100.05 149.01 23.92 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.195 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.4 mtp-105 -144.41 143.73 31.06 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.32 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mt -103.01 118.85 50.57 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.842 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.689 HD12 ' CD2' ' A' ' 8' ' ' PHE . 34.1 mt -128.97 135.92 60.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 CA-C-O 120.77 0.319 . . . . 0.0 111.24 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -105.15 140.92 37.59 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.337 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.552 ' CE2' HG13 ' A' ' 28' ' ' VAL . 8.5 m-85 -128.3 119.77 25.75 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.026 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.2 t -73.61 125.77 28.78 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.017 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 79.9 mtt180 -63.15 148.21 93.31 Favored Pre-proline 0 CA--C 1.53 0.201 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.237 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.19 134.01 33.4 Favored 'Cis proline' 0 C--N 1.35 0.612 0 C-N-CA 123.33 -1.529 . . . . 0.0 112.61 0.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.471 ' O ' HG13 ' A' ' 23' ' ' VAL . 11.6 p -79.58 114.28 20.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 121.014 0.435 . . . . 0.0 110.948 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.477 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.6 OUTLIER -102.53 140.64 36.54 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.197 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -59.15 -38.47 79.76 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.929 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -60.44 -45.06 95.03 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.637 0.256 . . . . 0.0 111.099 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -66.29 -42.33 88.53 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.179 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.587 ' O ' HG23 ' A' ' 32' ' ' VAL . 40.8 t -70.33 -48.99 57.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.07 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -61.75 -44.53 96.72 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.444 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -58.52 -39.0 78.92 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.559 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.744 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.3 OUTLIER -67.05 -47.61 70.81 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.761 179.537 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.587 HG23 ' O ' ' A' ' 28' ' ' VAL . 26.3 t -62.51 -44.34 99.22 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.149 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 54.8 m -62.43 -39.1 92.22 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.23 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.0 m -71.68 -45.08 63.02 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 121.253 -0.179 . . . . 0.0 111.467 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.744 HG23 ' O ' ' A' ' 31' ' ' LYS . 50.8 t -60.14 -50.19 81.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.492 0.187 . . . . 0.0 111.373 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.461 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 25.0 m-85 -82.33 -25.24 34.07 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.05 22.05 69.44 Favored Glycine 0 CA--C 1.524 0.641 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.996 -179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -152.63 152.0 27.92 Favored Pre-proline 0 N--CA 1.463 0.217 0 CA-C-N 116.949 0.374 . . . . 0.0 110.997 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.425 ' HG2' ' HB3' ' A' ' 83' ' ' ASP . 60.7 Cg_endo -72.64 85.0 1.16 Allowed 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.599 2.2 . . . . 0.0 112.131 179.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.7 mp -85.83 145.09 27.36 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.225 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -97.78 139.73 33.22 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.952 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.8 mt -98.54 127.83 44.63 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.981 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -115.31 116.29 28.05 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.082 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -91.87 108.15 19.72 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.894 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -104.99 117.5 34.16 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.476 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -76.32 -59.97 2.54 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.785 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -178.38 -51.04 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.265 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -103.58 -31.98 9.66 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.522 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.5 tp -119.8 156.4 30.7 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.805 0.336 . . . . 0.0 111.637 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.9 t -116.74 131.28 56.99 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.136 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.9 mm -114.29 133.84 59.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.977 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.517 HD22 ' HG2' ' A' ' 54' ' ' LYS . 5.7 tt -96.55 135.19 38.79 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.768 0.318 . . . . 0.0 110.847 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.459 HD23 ' HB2' ' A' ' 58' ' ' ASP . 3.0 mt -87.83 102.1 14.36 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.176 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.517 ' HG2' HD22 ' A' ' 52' ' ' LEU . 0.0 OUTLIER -106.35 -35.17 7.22 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.349 179.74 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 22.9 p30 -142.8 -179.94 6.63 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.314 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -61.2 -33.62 73.76 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.814 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -53.06 -42.82 66.17 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.951 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.459 ' HB2' HD23 ' A' ' 53' ' ' LEU . 61.7 m-20 -65.28 -44.59 87.54 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.903 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.508 ' HG ' HD11 ' A' ' 63' ' ' ILE . 12.7 tp -67.81 -40.15 83.87 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.09 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -61.21 -43.25 99.18 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.781 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -64.48 -44.0 92.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.416 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.23 -45.67 92.31 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.864 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.508 HD11 ' HG ' ' A' ' 59' ' ' LEU . 15.0 mt -66.47 -42.16 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-O 120.556 0.217 . . . . 0.0 110.925 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -56.76 -45.63 81.95 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.244 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 15.9 mt -70.28 -41.24 78.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.235 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.8 tp -61.25 -46.85 88.67 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.952 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.3 -38.43 89.35 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 120.733 0.302 . . . . 0.0 110.83 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 mmm180 -62.43 -33.75 75.42 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.281 179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.9 t -87.69 103.12 15.3 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.978 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 85.5 p -61.78 -31.95 72.19 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.288 179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.7 m -60.32 -42.74 96.24 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.924 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.2 mtt -68.61 151.41 46.77 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.119 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 17.8 mtpt -135.83 -64.74 0.61 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.212 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -88.36 173.0 8.99 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.023 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.534 ' HB2' HG23 ' A' ' 6' ' ' ILE . 6.9 mp -112.97 125.82 54.81 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.103 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 9.1 mtt-85 -92.57 107.49 19.25 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.711 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 32.4 mt -129.59 132.25 66.37 Favored 'Isoleucine or valine' 0 C--O 1.232 0.167 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.868 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.3 tp -102.08 127.38 49.0 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.71 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 8' ' ' PHE . 1.6 mt -93.67 127.71 39.5 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.099 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 mp -132.5 142.97 49.44 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.867 0.365 . . . . 0.0 111.375 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.6 p -85.47 87.85 7.44 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.968 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -118.95 76.0 1.07 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.359 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.425 ' HB3' ' HG2' ' A' ' 39' ' ' PRO . 6.5 p-10 -92.18 96.22 10.18 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.416 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 67.91 107.1 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.522 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -95.54 84.81 4.04 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.974 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 64.26 170.5 0.18 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.663 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -97.5 86.93 3.97 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.921 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.53 -178.26 3.89 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.918 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -122.13 123.86 42.54 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.916 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 26.8 m80 -112.66 100.47 8.73 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.903 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -129.62 132.01 46.63 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.008 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.8 112.03 9.75 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.848 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 28.5 t60 . . . . . 0 C--O 1.251 1.151 0 CA-C-O 118.36 -0.828 . . . . 0.0 111.106 179.969 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 120.666 0.269 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.435 ' O ' ' HA ' ' A' ' 20' ' ' SER . 1.6 m -118.8 154.53 32.69 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.258 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -165.08 94.64 0.66 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.818 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.513 HG23 ' HG3' ' A' ' 21' ' ' ARG . 39.5 t -71.82 131.05 35.11 Favored 'Isoleucine or valine' 0 C--O 1.232 0.163 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.107 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.451 ' NE ' HG21 ' A' ' 16' ' ' ILE . 5.7 ttt180 -86.65 110.45 19.86 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.96 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 21.7 mt -113.56 129.46 69.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.95 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -100.85 123.26 44.78 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.812 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.602 ' CD2' HD12 ' A' ' 17' ' ' ILE . 99.1 m-85 -115.54 133.46 56.02 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.009 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -134.1 127.63 32.52 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.909 0.385 . . . . 0.0 111.326 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -148.43 131.19 16.02 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.59 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 60.51 29.54 19.09 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.266 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.29 -13.86 59.0 Favored Glycine 0 CA--C 1.525 0.707 0 C-N-CA 120.857 -0.687 . . . . 0.0 113.288 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -83.22 107.74 15.97 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 117.056 0.428 . . . . 0.0 110.942 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.0 ptt180 -97.27 135.99 38.4 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.108 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.9 ptt180 -149.75 155.47 40.2 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.3 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.451 HG21 ' NE ' ' A' ' 5' ' ' ARG . 4.3 mt -117.83 120.09 63.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.848 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.602 HD12 ' CD2' ' A' ' 8' ' ' PHE . 22.9 mt -117.39 132.14 68.06 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.252 -179.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.67 137.07 38.65 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.092 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -128.85 125.88 38.62 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.044 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 2' ' ' SER . 78.3 p -67.75 139.37 56.67 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.177 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.513 ' HG3' HG23 ' A' ' 4' ' ' VAL . 11.4 mtm180 -88.9 149.67 43.99 Favored Pre-proline 0 C--O 1.234 0.241 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.144 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -74.63 122.34 8.0 Favored 'Cis proline' 0 C--N 1.351 0.669 0 C-N-CA 123.64 -1.4 . . . . 0.0 112.498 0.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.41 ' N ' ' HA ' ' A' ' 21' ' ' ARG . 12.3 p -70.59 125.36 28.72 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.133 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.755 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 28' ' ' VAL . 3.9 mttp -95.88 130.37 42.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.876 -179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -56.17 -38.41 70.88 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.741 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.86 -44.36 94.18 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.826 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.46 -41.62 88.77 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.252 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 24' ' ' LYS . 39.3 t -68.03 -48.99 72.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.971 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.26 -43.08 92.47 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.848 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 -42.18 80.73 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.911 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.74 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -63.43 -48.1 79.19 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.222 179.601 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.0 t -62.6 -42.47 96.07 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.287 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.5 m -63.93 -39.06 93.3 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.044 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 35.0 m -71.51 -47.15 57.15 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.74 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.3 t -58.54 -49.46 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 120.52 0.2 . . . . 0.0 111.506 -179.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.476 ' CE2' HD13 ' A' ' 79' ' ' LEU . 25.4 m-85 -83.6 -24.66 31.38 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 74.85 26.29 67.35 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.98 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -157.78 155.94 27.62 Favored Pre-proline 0 C--O 1.233 0.189 0 CA-C-N 116.864 0.332 . . . . 0.0 111.173 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.94 95.65 0.91 Allowed 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.657 2.238 . . . . 0.0 112.165 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mp -100.32 148.6 24.5 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.068 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -100.47 139.78 35.66 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.996 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.452 HD22 HG21 ' A' ' 77' ' ' ILE . 35.6 mt -87.68 106.3 17.95 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.662 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -100.53 114.93 28.96 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.017 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.471 ' CZ ' ' HB1' ' A' ' 62' ' ' ALA . 1.1 t80 -93.46 126.9 38.85 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.168 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -128.26 116.83 20.46 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.812 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -77.5 -49.18 15.28 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.436 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -172.83 -62.93 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.476 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -109.65 -23.64 11.35 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.771 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.35 141.07 36.57 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.839 0.352 . . . . 0.0 111.581 -179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.59 128.16 55.54 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.964 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.2 mt -122.16 133.08 69.57 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.758 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.5 tt -95.07 135.32 36.75 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.4 mt -97.15 108.79 21.59 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.94 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.4 tptp -107.84 -40.94 5.12 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.221 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 40.1 p-10 -129.93 179.65 5.74 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.474 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -61.63 -30.92 71.02 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.185 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.25 -46.72 72.66 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.057 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -68.61 -37.52 79.83 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.847 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 tp -66.9 -43.7 82.72 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.805 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -66.53 -37.42 84.98 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.154 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -37.01 84.39 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.762 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.471 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -65.37 -43.64 90.15 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.081 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.635 HD13 HD21 ' A' ' 75' ' ' LEU . 39.4 mm -64.12 -43.25 97.4 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.143 179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -53.82 -46.02 71.0 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.859 0.361 . . . . 0.0 110.848 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.6 mt -64.53 -39.43 85.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.966 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 tp -65.23 -46.73 79.43 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.188 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.42 ' OD2' HG22 ' A' ' 63' ' ' ILE . 10.9 m-20 -61.27 -36.61 80.49 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.686 0.279 . . . . 0.0 111.061 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 31.9 mtt-85 -60.39 -33.53 72.61 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.421 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.6 p -80.32 132.97 35.89 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.728 0.299 . . . . 0.0 111.168 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.2 p -76.21 -33.87 59.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.681 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.2 p -97.31 38.13 1.28 Allowed 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -57.82 142.78 44.6 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.808 0.337 . . . . 0.0 111.508 -179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.96 73.37 1.48 Allowed 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.848 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 5.7 t 60.64 -169.05 0.16 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.488 179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.635 HD21 HD13 ' A' ' 63' ' ' ILE . 2.2 mp -111.01 133.4 53.43 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.024 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 15.4 mtt85 -101.61 107.49 18.76 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.835 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.452 HG21 HD22 ' A' ' 42' ' ' LEU . 29.9 mt -129.47 132.13 66.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.872 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.499 HD23 HD11 ' A' ' 80' ' ' LEU . 0.9 OUTLIER -101.98 120.58 40.64 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.668 179.762 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.562 HD11 ' HB3' ' A' ' 8' ' ' PHE . 1.8 mt -95.76 124.85 39.97 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.95 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.499 HD11 HD23 ' A' ' 78' ' ' LEU . 11.3 mt -137.41 147.71 45.63 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.006 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 4.2 m -76.81 122.97 25.54 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.074 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -121.17 36.5 4.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.381 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -159.22 79.67 0.75 Allowed 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.934 0.397 . . . . 0.0 110.843 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.07 74.86 4.08 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.421 -179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -141.88 -177.16 5.07 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.105 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.69 157.18 37.76 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.837 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -90.69 -40.07 12.08 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.191 179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.9 m170 -137.74 143.79 41.35 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.748 0.309 . . . . 0.0 111.162 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -147.08 140.3 25.35 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.996 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.6 m-70 63.75 90.9 0.08 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.121 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -92.74 131.61 37.66 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.126 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -76.97 154.77 33.22 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.077 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.057 -0.973 . . . . 0.0 111.384 179.964 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 120.476 0.179 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.1 p -162.41 91.5 0.77 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.0 0.429 . . . . 0.0 111.099 179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -163.92 96.31 0.81 Allowed 'General case' 0 C--O 1.233 0.194 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.466 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 24.2 t -70.23 126.55 30.63 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.608 0.242 . . . . 0.0 110.604 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.6 mtt180 -86.89 112.75 22.07 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.047 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.435 HD12 ' HD2' ' A' ' 19' ' ' PHE . 4.9 mt -113.23 136.02 50.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.901 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -97.63 127.79 43.85 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.829 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.7 m-85 -108.89 134.74 51.16 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.997 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.24 125.87 50.16 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.263 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -149.2 123.4 9.53 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.556 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 57.99 35.52 25.33 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 120.93 0.395 . . . . 0.0 110.878 -179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.19 12.76 76.29 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.126 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -100.98 145.77 28.26 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.934 0.367 . . . . 0.0 110.96 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -97.79 142.74 29.18 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.217 -179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.403 ' NH2' HG11 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -144.29 136.91 26.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.188 179.858 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.4 mm -115.16 112.38 39.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.173 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.865 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 24.3 mm -129.56 125.98 62.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.928 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.74 146.47 26.5 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.307 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.435 ' HD2' HD12 ' A' ' 6' ' ' ILE . 46.5 m-85 -131.26 120.95 23.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.836 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 67.4 p -68.08 145.41 54.45 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.968 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.4 mtt85 -87.55 143.17 33.59 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.086 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -77.52 144.32 76.89 Favored 'Cis proline' 0 C--N 1.349 0.602 0 C-N-CA 123.337 -1.526 . . . . 0.0 112.81 0.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.1 p -99.24 130.44 48.19 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.989 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.461 ' O ' HG23 ' A' ' 28' ' ' VAL . 7.4 mmtt -102.27 133.19 47.57 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.805 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.43 ' HE1' HD12 ' A' ' 42' ' ' LEU . 75.8 t80 -57.88 -38.51 75.89 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.927 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.81 -44.11 97.29 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.994 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -62.94 -44.29 96.48 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.125 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.773 ' O ' HG23 ' A' ' 32' ' ' VAL . 23.9 t -61.29 -48.14 90.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.788 179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -65.19 -43.97 89.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.229 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -57.73 -47.05 83.54 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.988 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.637 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -61.05 -44.7 96.99 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.861 179.797 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.773 HG23 ' O ' ' A' ' 28' ' ' VAL . 38.5 t -61.24 -42.7 94.48 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.914 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.4 m -61.66 -39.5 91.61 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.969 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.6 m -71.58 -47.96 51.4 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.755 -0.202 . . . . 0.0 111.373 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 31' ' ' LYS . 42.7 t -61.84 -50.16 81.32 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-O 120.62 0.248 . . . . 0.0 111.245 -179.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -78.25 -24.13 47.02 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.649 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.61 19.17 74.13 Favored Glycine 0 CA--C 1.525 0.662 0 C-N-CA 121.07 -0.585 . . . . 0.0 113.166 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -168.4 154.31 6.76 Favored Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 116.867 0.334 . . . . 0.0 110.74 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.78 143.62 46.43 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.584 2.189 . . . . 0.0 112.387 179.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.658 HD13 HG12 ' A' ' 32' ' ' VAL . 1.1 mp -138.07 163.34 31.85 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.072 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.6 125.88 51.16 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.446 HD23 ' HB3' ' A' ' 79' ' ' LEU . 75.2 mt -84.29 113.33 21.05 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.035 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 121.65 44.62 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.193 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.476 ' CE2' ' HB1' ' A' ' 62' ' ' ALA . 21.0 t80 -108.31 116.67 32.39 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.365 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 27.3 mtt -104.3 133.67 48.81 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.984 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -90.8 -51.13 5.52 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.742 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -171.41 -62.47 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.531 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -107.98 -29.15 9.17 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.43 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.21 160.22 16.0 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.914 0.388 . . . . 0.0 111.32 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.44 132.38 56.24 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.901 179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 30.8 mt -113.65 134.38 56.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.83 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.08 126.73 35.26 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.182 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 44' ' ' TYR . 5.7 mt -88.16 86.48 7.1 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.648 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -106.0 -33.0 8.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.292 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -117.11 158.61 23.92 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.726 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -59.9 -35.01 73.95 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.711 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.14 -39.96 70.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.117 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -60.75 -45.51 94.03 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.91 0.386 . . . . 0.0 110.793 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 tp -71.04 -38.31 72.54 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.001 179.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.61 -43.15 90.5 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.108 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -34.37 77.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.954 179.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.476 ' HB1' ' CE2' ' A' ' 44' ' ' TYR . . . -62.36 -39.77 94.23 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.299 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 34.4 mm -66.48 -42.88 90.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.595 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -59.03 -45.36 90.93 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.984 179.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 12.5 mt -65.75 -44.44 93.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.026 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 7.5 tp -63.67 -37.96 89.3 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.173 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -57.47 -38.15 74.05 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.995 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.98 -31.56 69.33 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.036 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.9 t -66.69 138.24 57.27 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.802 0.334 . . . . 0.0 111.355 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.9 m -75.55 -35.15 60.73 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.43 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 53.2 p -96.39 37.41 1.26 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.45 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.94 105.45 0.57 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.776 0.322 . . . . 0.0 110.775 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.46 86.9 2.65 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.588 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 20.8 p 55.33 -173.8 0.05 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.416 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 75' ' ' LEU . 3.7 mm? -112.75 130.22 56.14 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 44.7 mtp180 -92.99 107.76 19.47 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.916 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.5 mt -129.54 131.18 67.23 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.763 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.76 118.8 37.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.42 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.446 ' HB3' HD23 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -119.95 129.58 54.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.006 -179.723 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.72 147.39 32.93 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.644 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.56 82.06 0.17 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.05 0.452 . . . . 0.0 110.808 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.43 44.31 0.7 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.472 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -73.36 90.2 1.65 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.5 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.8 mtt180 -148.91 -81.06 0.12 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.111 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -179.3 166.39 1.48 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.78 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.8 mt 61.75 -176.52 0.13 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.326 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -106.89 178.29 4.6 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.445 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -35.43 63.78 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.354 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.02 158.27 0.16 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.326 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 24.5 m-70 57.13 74.94 0.39 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.429 -179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -153.93 -46.52 0.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.396 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 39.0 m-70 -127.14 36.67 4.39 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.75 0.309 . . . . 0.0 111.086 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 26.3 t60 . . . . . 0 C--O 1.252 1.2 0 CA-C-O 118.715 -0.66 . . . . 0.0 111.681 179.734 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.673 0.273 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 4.0 m -133.62 -174.42 3.51 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.856 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' A' ' 2' ' ' SER . 7.6 m-20 67.2 109.81 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.216 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.6 t -107.37 117.74 53.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.996 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.23 105.15 17.02 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.501 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 31.5 mt -100.5 116.89 44.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.245 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 3.7 tttp -109.03 113.73 26.85 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.643 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.63 ' HB2' HD11 ' A' ' 79' ' ' LEU . 24.3 p90 -117.34 146.13 43.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.244 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -128.34 144.46 51.13 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.354 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -143.37 113.05 6.99 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.491 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 m120 57.6 39.28 27.73 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.233 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.56 -14.09 60.68 Favored Glycine 0 CA--C 1.524 0.616 0 C-N-CA 120.997 -0.62 . . . . 0.0 113.346 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -86.33 103.69 15.15 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 117.066 0.433 . . . . 0.0 110.636 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.98 140.44 29.65 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.273 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.5 mtt85 -134.72 138.59 44.5 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.99 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.4 mt -117.48 123.38 71.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.134 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.7 mt -136.18 132.82 49.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.199 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -102.74 136.25 42.91 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.036 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.479 ' CE2' HG13 ' A' ' 28' ' ' VAL . 83.8 m-85 -124.84 125.56 44.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.792 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -71.5 124.93 25.75 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -73.0 146.39 87.4 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.056 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -74.79 129.19 17.89 Favored 'Cis proline' 0 C--N 1.349 0.568 0 C-N-CA 123.697 -1.376 . . . . 0.0 112.543 -0.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.2 p -96.55 130.58 44.99 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.249 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.428 ' O ' HG23 ' A' ' 28' ' ' VAL . 9.8 mmtm -89.56 139.84 30.14 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.029 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 65.2 t80 -59.22 -44.91 92.28 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.04 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.35 -38.86 78.06 Favored 'General case' 0 C--O 1.231 0.098 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.954 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -65.23 -44.45 88.22 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.033 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.479 HG13 ' CE2' ' A' ' 19' ' ' PHE . 23.2 t -68.19 -49.26 68.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.871 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -59.28 -41.67 89.45 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.176 179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -57.73 -41.68 82.32 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.983 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.754 ' O ' HG23 ' A' ' 35' ' ' VAL . 6.6 tttt -63.29 -48.07 79.65 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.244 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.42 -42.14 94.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.135 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 85.4 m -65.44 -39.05 91.61 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.228 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.6 m -71.35 -44.71 64.52 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.895 -0.139 . . . . 0.0 111.337 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.754 HG23 ' O ' ' A' ' 31' ' ' LYS . 54.3 t -60.33 -50.02 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.509 0.195 . . . . 0.0 111.214 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.62 ' CE2' HD13 ' A' ' 79' ' ' LEU . 25.7 m-85 -80.17 -26.37 39.33 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.742 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.88 26.75 55.32 Favored Glycine 0 CA--C 1.522 0.475 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.823 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.541 ' O ' HD12 ' A' ' 40' ' ' LEU . 5.5 pt20 -167.21 156.21 9.3 Favored Pre-proline 0 N--CA 1.462 0.169 0 CA-C-N 116.764 0.282 . . . . 0.0 111.0 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.38 109.39 2.83 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.575 2.183 . . . . 0.0 112.279 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.551 HD23 ' HB3' ' A' ' 79' ' ' LEU . 5.6 mp -107.84 134.84 50.2 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.926 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -84.91 133.07 34.3 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.736 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.43 ' HB3' HG21 ' A' ' 77' ' ' ILE . 2.4 mp -92.31 108.81 20.23 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.873 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -104.9 118.93 37.79 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.22 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.426 ' OH ' HD12 ' A' ' 75' ' ' LEU . 1.1 t80 -91.04 128.89 37.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.81 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.8 ptm -128.42 114.5 16.9 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.801 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -85.36 -54.15 4.77 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.546 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -167.12 -64.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.401 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -109.5 -23.71 11.36 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.748 179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.4 tt -111.91 146.92 36.91 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 120.86 0.362 . . . . 0.0 111.305 -179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.6 m -120.52 132.78 55.35 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.896 179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mp -116.19 133.8 61.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.658 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.4 tt -98.12 126.56 43.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 120.831 0.348 . . . . 0.0 110.86 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.8 mt -70.89 97.89 1.49 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.109 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.29 -38.13 11.67 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.182 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -152.61 -173.69 4.65 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.32 -30.79 69.74 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.267 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -53.21 -50.39 64.79 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.081 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.36 -43.5 98.68 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.986 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.51 -38.05 89.65 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.845 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.866 ' HA ' HD12 ' A' ' 63' ' ' ILE . 1.1 t0 -61.39 -43.48 98.79 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.731 179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -35.53 81.35 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.908 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.579 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.58 -35.32 80.12 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.249 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.866 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.2 mt -64.67 -42.76 95.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.135 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.748 179.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.16 -39.56 63.68 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.031 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.579 HD12 ' HA ' ' A' ' 62' ' ' ALA . 13.8 mt -66.32 -39.46 84.24 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.847 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.809 HD13 HD13 ' A' ' 75' ' ' LEU . 9.3 tp -62.71 -42.85 99.86 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.986 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -64.02 -34.4 77.91 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.336 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 50.8 ttt85 -75.43 -34.05 60.97 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.098 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.6 t -85.74 129.41 34.84 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.344 -179.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -79.46 -40.49 29.71 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.015 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -75.36 -41.78 55.7 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.34 -179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.49 101.3 0.17 Allowed 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.799 0.333 . . . . 0.0 111.062 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.13 -37.48 11.57 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.933 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.3 p -121.55 175.24 6.31 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.723 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.809 HD13 HD13 ' A' ' 66' ' ' LEU . 1.4 mm? -101.99 129.78 48.36 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.694 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -86.75 108.79 18.85 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.007 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.43 HG21 ' HB3' ' A' ' 42' ' ' LEU . 2.9 mt -124.81 132.08 71.79 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.095 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.4 tp -102.17 122.67 44.62 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.483 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.63 HD11 ' HB2' ' A' ' 8' ' ' PHE . 4.6 mt -96.18 135.98 37.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.085 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.04 135.89 14.54 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.984 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.3 p -58.64 107.66 0.54 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.98 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -121.86 62.77 0.93 Allowed 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.93 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -98.62 50.3 0.98 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.421 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 53.12 33.61 15.48 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.402 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -145.03 158.78 43.71 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.183 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.431 ' O ' HD12 ' A' ' 86' ' ' LEU . 1.7 pp -150.82 128.66 11.67 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.287 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.6 75.16 0.93 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.968 0.413 . . . . 0.0 110.783 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -85.18 81.05 8.99 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.918 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -158.23 -176.73 6.07 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.941 -179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -80.34 149.67 30.18 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.996 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 19.5 p-80 -141.5 144.86 34.57 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.976 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 12.7 m80 -108.62 122.26 46.72 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.38 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.604 -0.712 . . . . 0.0 111.323 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 120.445 0.164 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.3 m 67.61 147.93 0.05 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.131 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 65.07 162.34 0.13 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.749 -179.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -144.81 132.7 16.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.036 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.81 111.28 20.6 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.512 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.484 HD12 ' CD1' ' A' ' 19' ' ' PHE . 27.7 mt -107.56 118.4 55.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.934 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -96.59 123.01 40.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.933 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.588 ' HB3' HD11 ' A' ' 79' ' ' LEU . 29.4 m-85 -115.73 127.15 54.91 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -122.13 132.62 54.56 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.829 0.347 . . . . 0.0 111.043 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.411 ' HB2' HD12 ' A' ' 79' ' ' LEU . 11.1 t-160 -146.04 117.2 7.84 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.652 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 59.52 33.22 22.09 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.21 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.71 -14.0 62.72 Favored Glycine 0 CA--C 1.525 0.658 0 C-N-CA 120.937 -0.649 . . . . 0.0 113.077 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -88.04 110.72 20.84 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.941 0.37 . . . . 0.0 110.887 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.66 144.3 28.9 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.201 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.1 mtt85 -133.49 149.81 51.72 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.993 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.523 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.7 mp -115.82 112.76 41.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.803 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.527 HD12 ' N ' ' A' ' 17' ' ' ILE . 3.5 mp -123.53 136.91 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 CA-C-O 120.861 0.362 . . . . 0.0 111.319 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -95.13 129.5 42.21 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.027 179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.484 ' CD1' HD12 ' A' ' 6' ' ' ILE . 21.4 m-85 -124.76 126.39 45.58 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.967 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 p -66.48 135.74 54.68 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.161 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -100.54 146.31 31.81 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.042 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.21 123.49 9.42 Favored 'Cis proline' 0 C--N 1.35 0.655 0 C-N-CA 123.335 -1.527 . . . . 0.0 112.499 -0.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.54 130.03 36.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 120.975 0.417 . . . . 0.0 111.254 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.562 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -89.54 146.39 24.62 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.044 -179.859 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -56.98 -37.27 71.38 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.083 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -61.32 -43.72 98.4 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.919 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.76 -39.18 87.77 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.142 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 24' ' ' LYS . 18.7 t -67.96 -48.85 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.141 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.872 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.46 ' O ' HG22 ' A' ' 33' ' ' THR . 0.2 OUTLIER -58.7 -44.68 90.38 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.926 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.433 ' HA ' HG22 ' A' ' 33' ' ' THR . 2.0 m80 -59.99 -37.03 78.48 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.126 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.692 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -70.94 -48.06 55.59 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.857 179.642 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 28' ' ' VAL . 31.2 t -65.5 -45.75 91.81 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.431 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.46 HG22 ' O ' ' A' ' 29' ' ' GLU . 14.7 t -61.0 -38.93 87.78 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.708 -179.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 68.6 m -71.24 -43.78 66.62 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.692 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.2 t -64.89 -50.53 74.71 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.27 0 CA-C-O 120.576 0.227 . . . . 0.0 111.419 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.565 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 92.1 m-85 -83.72 -13.34 54.23 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 66.26 24.03 71.86 Favored Glycine 0 CA--C 1.524 0.601 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.88 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -153.15 147.31 18.75 Favored Pre-proline 0 CA--C 1.529 0.172 0 CA-C-N 116.752 0.276 . . . . 0.0 110.961 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.24 71.73 5.05 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.559 2.173 . . . . 0.0 112.124 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.4 mp -76.92 131.55 38.61 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.847 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -76.98 140.09 40.3 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.991 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.54 HD22 HG21 ' A' ' 77' ' ' ILE . 33.5 mt -82.18 118.58 23.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.897 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -116.94 119.6 35.83 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.995 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.554 ' HB2' HD11 ' A' ' 53' ' ' LEU . 0.8 OUTLIER -90.63 117.27 29.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.82 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.7 115.65 22.44 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.827 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -86.53 -72.21 0.51 Allowed 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.053 -179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -134.9 -67.43 0.56 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.608 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -122.78 18.56 10.26 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.207 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.0 tp -131.68 138.22 48.62 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.604 0.24 . . . . 0.0 110.979 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -121.97 122.52 39.54 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.765 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.8 mp -114.44 131.14 67.36 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.684 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.2 tt -92.13 127.88 37.77 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-O 120.874 0.369 . . . . 0.0 111.116 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.782 ' CD2' HD12 ' A' ' 59' ' ' LEU . 5.8 mp -92.95 90.06 6.8 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.789 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.88 -31.82 15.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.145 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -132.08 174.49 10.14 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.989 -179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.59 -32.05 72.98 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.294 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -54.28 -42.2 69.74 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.71 0.29 . . . . 0.0 110.94 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -64.64 -46.19 83.59 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.162 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.782 HD12 ' CD2' ' A' ' 53' ' ' LEU . 2.3 tp -61.77 -41.92 98.32 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.599 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.841 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.5 t0 -61.52 -41.77 97.81 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.734 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.87 -39.49 94.33 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.835 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.435 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -62.81 -38.42 90.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.333 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.841 HD12 ' HA ' ' A' ' 60' ' ' ASP . 7.5 mt -64.37 -44.04 97.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.194 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.599 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -56.0 -42.4 76.35 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.052 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.435 HD12 ' HA ' ' A' ' 62' ' ' ALA . 17.1 mt -66.12 -45.57 90.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.112 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.454 ' CD2' HD11 ' A' ' 75' ' ' LEU . 8.4 tp -58.9 -43.47 91.04 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.803 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -69.29 -36.77 77.38 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.036 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.53 -26.64 68.8 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.27 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.2 t -62.36 164.72 6.83 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.912 0.386 . . . . 0.0 111.382 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 p -64.06 -40.72 96.89 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.185 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.5 p -163.93 -63.92 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.232 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 63.16 -177.58 0.15 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.135 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -152.61 115.41 4.57 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.789 -179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.513 ' C ' HD12 ' A' ' 75' ' ' LEU . 0.4 OUTLIER 64.06 -172.2 0.17 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.954 -179.872 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.513 HD12 ' C ' ' A' ' 74' ' ' SER . 8.2 mp -125.39 125.85 44.06 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.721 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -86.2 107.07 17.73 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.914 0.387 . . . . 0.0 110.606 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.54 HG21 HD22 ' A' ' 42' ' ' LEU . 8.2 mt -127.85 131.53 69.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.723 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.47 ' HA ' HD13 ' A' ' 78' ' ' LEU . 3.6 mm? -101.93 128.95 48.11 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.538 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.588 HD11 ' HB3' ' A' ' 8' ' ' PHE . 1.4 mt -94.15 133.65 37.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.023 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.7 mt -135.37 143.78 46.25 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.146 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 43.3 t -88.16 101.54 13.92 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.899 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -115.12 30.49 7.32 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.728 179.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -72.18 119.45 16.39 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.8 0.333 . . . . 0.0 111.022 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.6 mtm180 -136.69 -53.96 0.72 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.88 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 66.37 148.31 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.368 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 87.1 mt 68.98 146.6 0.06 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.641 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 62.45 98.98 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.404 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -134.61 -73.69 0.47 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.736 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -172.07 41.89 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.992 0.425 . . . . 0.0 110.436 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -148.34 -47.33 0.15 Allowed 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.108 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 63.66 28.63 15.06 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.67 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 70.2 137.14 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.797 0.332 . . . . 0.0 111.43 179.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 3.3 m80 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 117.903 -1.046 . . . . 0.0 111.016 -179.85 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.423 ' HB2' ' HB2' ' A' ' 21' ' ' ARG . 3.4 m -151.37 -174.9 4.97 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.311 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -169.53 137.29 1.78 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.214 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -138.75 141.43 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.245 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -95.01 105.5 17.42 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.916 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.455 HG23 HD12 ' A' ' 75' ' ' LEU . 2.7 mt -111.72 116.96 53.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.882 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -96.1 118.31 32.43 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.75 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.669 ' HB3' HD11 ' A' ' 79' ' ' LEU . 36.4 m-85 -96.83 129.17 44.3 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.019 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.405 ' O ' HD12 ' A' ' 79' ' ' LEU . 5.4 tt0 -119.09 128.68 54.55 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.875 0.369 . . . . 0.0 111.691 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -142.2 120.1 11.99 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.525 179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 44.1 t30 54.96 38.28 30.21 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 120.793 0.33 . . . . 0.0 111.072 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 84.52 -14.51 46.09 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 121.168 -0.539 . . . . 0.0 113.588 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -87.32 121.02 29.22 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 117.22 0.51 . . . . 0.0 110.855 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -100.33 154.45 18.48 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.369 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.9 mtt-85 -140.04 139.97 36.07 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.913 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 27.9 mt -108.75 114.79 47.75 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.225 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.8 mt -139.88 136.06 38.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.235 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -96.69 133.57 41.06 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.303 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.412 ' HB2' ' CD1' ' A' ' 6' ' ' ILE . 21.5 m-85 -121.86 129.36 52.53 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.89 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.24 157.87 25.03 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.869 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.423 ' HB2' ' HB2' ' A' ' 2' ' ' SER . 2.0 mtm105 -109.51 153.98 42.56 Favored Pre-proline 0 C--O 1.234 0.253 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.113 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.421 ' HA ' ' HB3' ' A' ' 21' ' ' ARG . 72.9 Cg_endo -75.74 131.79 25.4 Favored 'Cis proline' 0 C--N 1.349 0.593 0 C-N-CA 123.189 -1.588 . . . . 0.0 112.756 0.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.9 p -105.6 125.73 60.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.871 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -87.04 137.46 32.33 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.727 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.484 ' CE1' HD12 ' A' ' 42' ' ' LEU . 65.5 t80 -55.68 -38.72 70.01 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.754 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.06 -43.49 95.39 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.165 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -62.63 -43.8 97.9 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.166 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.498 ' O ' HG23 ' A' ' 32' ' ' VAL . 39.8 t -69.09 -45.15 80.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.457 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.9 tm-20 -61.81 -38.4 87.96 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.358 179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.87 -47.46 82.65 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.807 -179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.675 ' O ' HG23 ' A' ' 35' ' ' VAL . 11.2 mtpp -61.4 -46.59 89.52 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.894 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 28' ' ' VAL . 48.2 t -57.47 -48.17 83.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.919 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 65.7 m -62.33 -39.37 92.87 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.37 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.1 m -71.71 -46.26 59.23 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 111.609 0.225 . . . . 0.0 111.609 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 31' ' ' LYS . 61.7 t -61.44 -50.16 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.514 0.197 . . . . 0.0 111.488 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 72.9 m-85 -83.4 -21.46 33.01 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 72.41 30.35 64.75 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.812 -179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.569 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -168.2 151.87 5.78 Favored Pre-proline 0 N--CA 1.463 0.2 0 CA-C-N 116.59 0.195 . . . . 0.0 111.081 -179.968 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -75.17 107.38 2.47 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.573 2.182 . . . . 0.0 112.236 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.569 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.4 mp -105.44 143.16 33.99 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.298 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -88.62 129.46 35.5 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.781 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.742 HD23 HD23 ' A' ' 79' ' ' LEU . 50.7 mt -86.12 103.01 14.37 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.904 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -93.08 120.92 33.89 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.101 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.55 ' CE2' ' HB1' ' A' ' 62' ' ' ALA . 0.6 OUTLIER -96.86 125.38 41.26 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.994 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.2 ptp -126.65 114.23 17.76 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.035 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -86.94 -54.3 4.42 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.801 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -157.13 -65.81 0.1 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.506 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -126.2 13.23 7.74 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.533 179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.6 tp -131.62 132.96 44.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.628 0.251 . . . . 0.0 110.961 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 m -110.51 126.07 53.99 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.963 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.0 mt -114.63 134.12 58.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.197 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.89 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 tt -92.08 122.3 34.45 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.81 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.427 HD21 ' HA ' ' A' ' 59' ' ' LEU . 3.1 mt -80.39 87.26 5.65 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.058 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.98 -31.75 14.78 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.382 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -142.85 -179.63 6.46 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.891 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -62.68 -31.35 72.23 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.14 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.24 -43.81 67.62 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 123.1 0.25 . . . . 0.0 111.099 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.25 -40.05 89.94 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.188 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.427 ' HA ' HD21 ' A' ' 53' ' ' LEU . 6.5 tp -69.3 -41.38 76.84 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.763 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -65.89 -40.21 91.34 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.341 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.8 tptt -62.67 -36.94 84.5 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.396 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.55 ' HB1' ' CE2' ' A' ' 44' ' ' TYR . . . -63.06 -38.31 90.69 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.343 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 54.0 mt -62.75 -42.52 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.005 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -54.25 -45.54 72.39 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.119 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 4.9 mt -69.37 -41.92 81.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.906 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.476 HD22 HD22 ' A' ' 75' ' ' LEU . 13.7 tp -61.39 -44.52 97.01 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.029 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -61.47 -39.26 90.24 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.045 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 7.8 mtm-85 -62.65 -34.3 76.79 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.243 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 24.0 t -87.01 119.98 27.78 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.806 0.336 . . . . 0.0 111.212 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 71.9 m -78.19 -32.47 50.08 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.253 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.6 p -93.47 35.7 1.1 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 120.699 0.285 . . . . 0.0 111.612 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.42 ' HE2' HD12 ' A' ' 66' ' ' LEU . 3.8 ttp -147.41 80.96 1.52 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.821 0.343 . . . . 0.0 110.816 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -103.18 31.44 4.27 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.335 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.5 m -156.52 142.52 18.03 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.65 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.879 HD12 HD11 ' A' ' 77' ' ' ILE . 0.1 OUTLIER -116.46 131.94 56.81 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.874 0.368 . . . . 0.0 111.189 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -99.72 118.15 35.61 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.048 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.879 HD11 HD12 ' A' ' 75' ' ' LEU . 2.3 mp -125.22 132.39 71.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.759 179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 mt -101.94 119.42 38.77 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.679 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.742 HD23 HD23 ' A' ' 42' ' ' LEU . 0.6 OUTLIER -93.39 119.95 33.1 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.998 -179.805 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.8 pp -130.9 136.54 48.69 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.978 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 54.7 p -73.84 145.98 44.5 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.788 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -95.99 36.14 1.34 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.402 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 -134.24 77.06 1.68 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.59 179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.82 94.85 4.94 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.905 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.3 m120 60.04 65.79 1.06 Allowed 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.45 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -169.46 88.51 0.17 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.195 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -112.48 -35.48 5.54 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.458 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 66.03 26.71 10.79 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 111.809 0.299 . . . . 0.0 111.809 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 69.25 -69.42 0.16 Allowed 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 122.548 0.339 . . . . 0.0 111.492 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -98.29 -164.01 1.1 Allowed 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 68.3 88.17 0.11 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.989 0.423 . . . . 0.0 111.205 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 17.8 p80 -56.7 -38.25 72.03 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.518 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.9 t60 . . . . . 0 C--O 1.251 1.141 0 CA-C-O 118.433 -0.794 . . . . 0.0 110.898 -179.99 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.585 0.231 . . . . 0.0 111.543 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.2 m 64.25 31.42 13.05 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.011 0.434 . . . . 0.0 110.754 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -82.37 107.56 15.13 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.424 179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.522 HG11 HD12 ' A' ' 63' ' ' ILE . 21.2 t -78.21 135.82 25.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.857 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.95 107.25 18.3 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.857 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.567 HD12 ' HD2' ' A' ' 19' ' ' PHE . 27.3 mt -110.01 120.6 61.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.977 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.09 119.2 38.4 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.669 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.905 ' HB3' HD11 ' A' ' 79' ' ' LEU . 49.7 m-85 -100.74 127.2 47.26 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.481 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.409 ' O ' HD12 ' A' ' 79' ' ' LEU . 25.8 tt0 -118.82 131.2 56.08 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 120.874 0.369 . . . . 0.0 111.37 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -141.74 120.62 12.75 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.513 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.0 m120 56.13 34.99 24.9 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.511 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.13 -14.19 61.37 Favored Glycine 0 CA--C 1.525 0.666 0 C-N-CA 120.915 -0.659 . . . . 0.0 113.159 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -89.43 116.93 27.98 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 117.055 0.428 . . . . 0.0 110.429 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.14 144.16 39.17 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.394 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.1 mtt-85 -133.98 139.41 46.06 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.9 mp -102.27 118.59 49.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.235 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.1 mp -137.04 129.96 44.53 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.974 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.31 142.87 27.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.118 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.567 ' HD2' HD12 ' A' ' 6' ' ' ILE . 43.1 m-85 -133.84 118.08 17.57 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.941 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.5 t -64.62 130.47 43.75 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.977 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.435 ' HG3' HG23 ' A' ' 4' ' ' VAL . 4.0 mtm180 -74.46 160.02 82.18 Favored Pre-proline 0 CA--C 1.53 0.195 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.346 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.86 130.17 19.9 Favored 'Cis proline' 0 C--N 1.35 0.609 0 C-N-CA 123.219 -1.576 . . . . 0.0 112.558 -0.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -71.61 125.18 29.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.021 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.445 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.1 OUTLIER -102.17 137.94 39.77 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.928 -179.709 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -55.91 -45.03 78.79 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.735 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -39.69 94.44 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.03 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.12 -44.41 95.71 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.105 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 24' ' ' LYS . 42.6 t -67.97 -48.42 74.93 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.881 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -39.24 93.48 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.111 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -58.0 -39.4 78.17 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.933 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.732 ' O ' HG23 ' A' ' 35' ' ' VAL . 4.1 tptt -69.23 -47.49 64.59 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.062 179.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.551 HG11 HD22 ' A' ' 79' ' ' LEU . 25.6 t -68.24 -43.6 84.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.477 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.7 m -60.38 -38.66 84.6 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.102 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.4 m -71.49 -43.79 65.91 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 111.464 0.172 . . . . 0.0 111.464 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.732 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.1 t -63.34 -50.86 77.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-O 120.535 0.207 . . . . 0.0 111.42 -179.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -83.48 -18.68 37.7 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.21 21.06 75.55 Favored Glycine 0 CA--C 1.523 0.546 0 C-N-CA 121.067 -0.587 . . . . 0.0 113.052 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.515 ' O ' HD12 ' A' ' 40' ' ' LEU . 34.1 mt-30 -149.71 151.64 33.23 Favored Pre-proline 0 CA--C 1.53 0.178 0 CA-C-N 116.94 0.37 . . . . 0.0 110.933 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -75.32 95.0 0.97 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.634 2.223 . . . . 0.0 112.122 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 38' ' ' GLN . 5.8 mp -93.52 145.32 24.6 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.232 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.452 ' OD2' HD11 ' A' ' 52' ' ' LEU . 4.2 t0 -91.96 130.92 37.61 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.733 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.625 HD23 HG21 ' A' ' 77' ' ' ILE . 4.3 mp -90.2 103.08 15.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.946 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.629 ' CE1' HD12 ' A' ' 52' ' ' LEU . 8.5 m-70 -94.71 120.08 34.37 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.197 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -99.08 120.54 39.64 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.537 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.02 129.67 56.17 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.671 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -90.46 -50.67 5.82 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.735 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -171.99 -63.63 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.454 179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -109.19 -26.69 9.97 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.397 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -105.27 138.99 40.6 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.754 0.312 . . . . 0.0 111.279 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.2 t -110.31 129.64 55.7 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.888 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.7 mt -120.01 134.09 64.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.811 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.629 HD12 ' CE1' ' A' ' 43' ' ' HIS . 3.3 tt -99.32 135.1 41.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.676 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.508 HD21 ' HA ' ' A' ' 59' ' ' LEU . 10.3 mt -73.85 86.48 1.74 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 121.024 0.44 . . . . 0.0 111.096 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.5 tptp -80.55 -36.63 32.76 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.234 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -152.33 178.54 9.42 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.247 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -58.3 -33.0 68.98 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.09 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.63 -43.47 72.3 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.699 0.285 . . . . 0.0 110.86 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -67.35 -40.44 85.85 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.676 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.508 ' HA ' HD21 ' A' ' 53' ' ' LEU . 9.3 tp -64.49 -44.6 90.45 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.153 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.3 -38.63 91.9 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.139 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.9 mttt -62.99 -41.93 99.7 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.494 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.82 -45.39 92.83 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.183 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.525 HD13 HD11 ' A' ' 75' ' ' LEU . 44.2 mm -65.04 -44.92 95.81 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.134 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.085 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.7 -45.54 85.56 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.379 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.9 mt -70.06 -45.16 77.27 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.969 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.567 HD21 ' O ' ' A' ' 74' ' ' SER . 9.2 tp -63.72 -46.4 85.56 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.375 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -58.78 -40.78 84.99 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.807 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -68.3 -33.59 74.6 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.101 179.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.6 t -82.31 113.91 20.43 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.923 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 3.6 m -75.25 -29.2 60.14 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.997 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -55.61 -35.26 65.65 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.184 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.9 mmm -108.46 154.85 21.31 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.102 179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.6 mmtm -134.77 -52.14 0.8 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.709 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.567 ' O ' HD21 ' A' ' 66' ' ' LEU . 1.9 p -79.0 169.73 17.76 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.034 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.624 HD22 HD11 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -111.58 121.65 45.71 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.044 179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.48 108.19 19.5 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.821 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.625 HG21 HD23 ' A' ' 42' ' ' LEU . 27.8 mt -128.94 132.2 67.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.104 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.853 HD23 HD11 ' A' ' 80' ' ' LEU . 3.5 tp -102.12 119.48 38.88 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.509 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.905 HD11 ' HB3' ' A' ' 8' ' ' PHE . 2.8 mt -93.54 131.64 38.6 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.955 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.853 HD11 HD23 ' A' ' 78' ' ' LEU . 5.0 mp -142.12 138.45 31.66 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.792 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m -65.29 134.85 54.49 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.371 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -107.65 33.88 3.83 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.202 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -155.89 99.01 1.95 Allowed 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.618 -0.265 . . . . 0.0 110.886 179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.45 -50.26 40.15 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.954 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.8 m120 65.68 112.57 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.891 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 tp -94.51 32.21 1.62 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.932 179.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -129.28 162.18 28.51 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.316 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER 70.12 147.7 0.07 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.18 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -135.72 -48.99 0.7 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.03 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 10.0 p-80 -164.97 117.79 1.22 Allowed 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.988 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -140.86 113.89 8.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.149 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 13.6 p80 -161.47 145.81 13.14 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.842 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.5 m170 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.262 179.955 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 120.85 0.357 . . . . 0.0 111.321 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.7 m -154.43 173.14 16.65 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.109 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 66.88 109.97 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.508 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.9 t -93.05 130.76 41.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.949 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -87.21 113.94 23.38 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.761 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 mm -106.69 123.98 61.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.21 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.406 ' HD3' HG13 ' A' ' 16' ' ' ILE . 0.0 OUTLIER -108.66 111.8 23.79 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.752 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.655 ' CD2' HD11 ' A' ' 79' ' ' LEU . 11.2 p90 -116.41 149.14 39.91 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.305 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -118.01 139.85 50.6 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.086 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.682 ' HB2' HD12 ' A' ' 79' ' ' LEU . 50.9 t-80 -146.03 114.54 6.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.436 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.6 t30 58.72 35.01 24.17 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.135 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.72 12.47 81.48 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 121.071 -0.585 . . . . 0.0 113.177 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -111.29 122.07 46.9 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 117.059 0.43 . . . . 0.0 110.736 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -93.32 139.72 30.34 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.147 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.439 ' HB2' ' CE2' ' A' ' 8' ' ' PHE . 16.0 mmt180 -139.04 136.7 35.56 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.161 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.406 HG13 ' HD3' ' A' ' 7' ' ' LYS . 2.4 mp -117.01 129.63 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.221 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 32.7 mt -140.92 129.62 24.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.131 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.6 134.61 34.27 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.031 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -129.2 121.48 27.76 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.045 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.1 p -66.39 136.49 55.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.898 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -77.41 147.22 75.31 Favored Pre-proline 0 C--O 1.233 0.211 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.993 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.83 133.84 31.9 Favored 'Cis proline' 0 C--N 1.35 0.633 0 C-N-CA 123.347 -1.522 . . . . 0.0 112.625 0.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.7 p -81.46 123.45 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.091 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -102.66 143.76 31.91 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.01 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.552 ' HB2' HD13 ' A' ' 59' ' ' LEU . 62.6 t80 -60.27 -42.1 94.71 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.6 179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.418 ' HG2' ' CD2' ' A' ' 30' ' ' HIS . 12.2 tt0 -57.89 -41.6 82.88 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.098 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -62.48 -44.45 96.37 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.62 -0.264 . . . . 0.0 111.087 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.715 ' O ' HG23 ' A' ' 32' ' ' VAL . 37.3 t -70.99 -48.44 55.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.893 179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -40.54 85.01 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.392 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . 0.418 ' CD2' ' HG2' ' A' ' 26' ' ' GLU . 4.5 m-70 -57.9 -46.67 84.59 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 120.697 0.284 . . . . 0.0 111.06 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.78 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.0 OUTLIER -71.4 -48.26 50.92 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.094 179.986 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 28' ' ' VAL . 48.4 t -56.99 -46.29 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.374 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 91.4 m -61.2 -38.85 88.06 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.952 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.1 m -71.3 -42.27 68.88 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 111.481 0.178 . . . . 0.0 111.481 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.78 HG23 ' O ' ' A' ' 31' ' ' LYS . 41.5 t -60.2 -49.97 82.07 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 CA-C-O 120.607 0.241 . . . . 0.0 111.068 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.686 ' CE2' HD13 ' A' ' 79' ' ' LEU . 69.7 m-85 -83.61 -25.79 30.55 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.883 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.35 14.0 62.7 Favored Glycine 0 CA--C 1.525 0.715 0 C-N-CA 121.015 -0.612 . . . . 0.0 113.03 -179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -154.39 152.16 25.6 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.977 0.389 . . . . 0.0 110.872 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.426 ' HG2' ' CB ' ' A' ' 83' ' ' ASP . 60.5 Cg_endo -72.46 79.74 1.78 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.641 2.227 . . . . 0.0 112.29 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.7 mp -75.31 140.03 42.85 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.878 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.0 136.81 32.79 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.02 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.536 HD22 HG21 ' A' ' 77' ' ' ILE . 10.9 mt -86.19 118.69 25.8 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.91 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 18.1 m170 -109.07 119.58 39.96 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.063 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -120.22 128.35 53.28 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 120.796 0.331 . . . . 0.0 110.672 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.5 mtm -110.49 118.52 36.47 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.377 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -60.8 -67.5 0.39 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.876 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.88 -59.79 0.18 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.37 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.456 ' O ' HD22 ' A' ' 49' ' ' LEU . 7.2 mt-10 -120.96 11.6 11.05 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.604 179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.456 HD22 ' O ' ' A' ' 48' ' ' GLU . 1.4 mm? -131.22 159.2 38.47 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.689 0.281 . . . . 0.0 111.019 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.4 p -118.1 118.53 32.14 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.05 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.7 mt -113.67 133.9 58.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.858 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.3 tt -96.44 123.29 40.04 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.945 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.734 HD23 ' HB3' ' A' ' 58' ' ' ASP . 7.3 mt -92.34 81.0 4.93 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.864 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.2 tttp -103.5 -32.82 9.29 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.972 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 79.4 m-20 -107.9 165.57 11.36 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.8 0.333 . . . . 0.0 111.102 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.52 -35.85 80.72 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.952 179.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.47 -42.65 74.63 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.025 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.734 ' HB3' HD23 ' A' ' 53' ' ' LEU . 54.8 m-20 -60.1 -44.48 94.79 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.661 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.552 HD13 ' HB2' ' A' ' 25' ' ' TYR . 4.9 tt -66.28 -40.69 90.27 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.074 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.11 -41.45 96.71 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.904 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -66.32 -37.27 84.99 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.061 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.509 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.17 -45.42 91.89 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.348 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 42.3 mm -66.11 -41.04 88.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.195 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.775 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -55.33 -41.17 72.1 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.085 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.509 HD12 ' HA ' ' A' ' 62' ' ' ALA . 7.6 mt -66.81 -41.43 87.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.922 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.798 HD22 HD21 ' A' ' 75' ' ' LEU . 38.5 tp -62.76 -41.98 99.47 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.007 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -58.62 -38.01 77.13 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.209 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.84 -31.75 64.99 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.298 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.9 t -98.9 93.09 5.84 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.219 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 89.2 p -67.88 -31.31 71.02 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.388 179.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.2 p -56.43 -43.67 79.65 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.182 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 6.2 ttp -83.47 157.39 22.45 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.223 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 50.4 mttm -143.73 -51.28 0.32 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.93 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.9 m -79.6 149.74 31.26 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.076 179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.798 HD21 HD22 ' A' ' 66' ' ' LEU . 3.9 mm? -113.9 126.48 55.22 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.898 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.5 mtt-85 -93.02 109.91 21.37 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.944 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.536 HG21 HD22 ' A' ' 42' ' ' LEU . 38.6 mt -128.93 132.2 67.6 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.094 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.7 mp -102.21 132.03 48.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.673 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.686 HD13 ' CE2' ' A' ' 36' ' ' PHE . 1.7 mt -94.15 132.34 38.78 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.09 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 89.1 mt -143.63 137.31 28.21 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.905 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.1 p -70.51 117.69 12.37 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.131 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -138.79 37.91 2.18 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.343 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.426 ' CB ' ' HG2' ' A' ' 39' ' ' PRO . 35.6 t70 -119.35 100.0 7.04 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.756 0.312 . . . . 0.0 111.124 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.2 mtt85 -112.88 -42.05 3.66 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.113 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -173.84 175.57 2.83 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.603 -179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -88.9 55.85 3.51 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.816 0.341 . . . . 0.0 110.624 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 59.95 -171.56 0.13 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.324 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 56.2 t60 -93.38 128.06 39.27 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.907 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -164.05 178.99 7.25 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.222 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -155.8 173.96 15.99 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.064 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -68.11 140.42 56.21 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.698 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 9.5 t-80 -86.69 136.09 33.15 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.838 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 3.4 m80 . . . . . 0 C--O 1.251 1.133 0 CA-C-O 118.579 -0.724 . . . . 0.0 111.419 -179.97 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 120.563 0.22 . . . . 0.0 111.586 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.4 m 68.44 69.17 0.31 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.086 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -166.32 70.54 0.12 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.887 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -85.72 135.88 24.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.173 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.6 ttm180 -95.84 106.16 18.26 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.888 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.442 HD12 ' CD2' ' A' ' 19' ' ' PHE . 33.3 mt -101.09 126.38 54.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.018 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.9 mttm -98.83 116.37 30.91 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.913 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 50.8 m-85 -93.38 145.63 24.34 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.247 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.32 132.76 50.2 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.348 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -146.14 113.85 6.42 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.626 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.2 m-20 58.3 33.74 23.42 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.12 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.96 -13.64 62.56 Favored Glycine 0 CA--C 1.526 0.719 0 C-N-CA 120.917 -0.659 . . . . 0.0 113.048 -179.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -77.05 152.58 35.03 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 117.007 0.404 . . . . 0.0 110.949 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -115.54 144.7 43.49 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.4 144.85 46.78 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.925 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.4 mt -115.51 120.28 64.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.18 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 31.3 mt -141.62 126.58 17.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.238 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.51 135.24 33.99 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.162 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.442 ' CD2' HD12 ' A' ' 6' ' ' ILE . 37.1 m-85 -127.02 128.37 46.23 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.051 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.9 p -87.1 123.06 31.75 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.669 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 5.2 mtt180 -64.91 154.08 86.96 Favored Pre-proline 0 C--O 1.233 0.232 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.264 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.39 127.34 14.79 Favored 'Cis proline' 0 C--N 1.35 0.616 0 C-N-CA 123.343 -1.524 . . . . 0.0 112.733 0.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.9 p -84.26 122.83 38.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.887 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.684 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -98.55 142.69 29.83 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.079 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.746 ' CE1' HD12 ' A' ' 42' ' ' LEU . 70.9 t80 -60.39 -42.41 95.84 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.987 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.416 ' HA ' ' HG2' ' A' ' 29' ' ' GLU . 16.2 mt-10 -61.56 -39.41 91.01 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.954 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -68.75 -44.28 74.07 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.015 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 24' ' ' LYS . 29.1 t -62.22 -48.02 90.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.838 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.416 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 10.8 pt-20 -63.78 -34.79 78.68 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.261 179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -58.2 -48.38 80.51 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.047 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.8 tttt -63.48 -40.59 97.5 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.743 179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 28' ' ' VAL . 41.8 t -64.97 -44.19 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.314 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.8 m -65.23 -38.88 91.75 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.965 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 m -71.55 -47.35 55.65 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.46 HG13 ' N ' ' A' ' 36' ' ' PHE . 13.5 p -59.92 -48.8 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.692 ' CE2' HD13 ' A' ' 79' ' ' LEU . 65.6 m-85 -84.01 -18.11 38.22 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.47 28.47 69.53 Favored Glycine 0 C--N 1.334 0.455 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.711 -179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.473 ' O ' HD12 ' A' ' 40' ' ' LEU . 1.2 pt20 -162.49 156.32 17.88 Favored Pre-proline 0 CA--C 1.529 0.158 0 CA-C-N 116.725 0.263 . . . . 0.0 110.922 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.417 ' HB3' ' CE1' ' A' ' 90' ' ' HIS . 61.0 Cg_endo -73.04 107.12 2.29 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.664 2.243 . . . . 0.0 112.526 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.503 HD23 ' HB3' ' A' ' 79' ' ' LEU . 6.1 mp -108.65 126.44 52.98 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.029 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -76.44 135.4 39.41 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.842 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.746 HD12 ' CE1' ' A' ' 25' ' ' TYR . 73.5 mt -83.18 95.59 8.16 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.932 0.396 . . . . 0.0 110.536 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 57.2 m-70 -87.56 118.01 26.75 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.188 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.471 ' CD1' HD12 ' A' ' 51' ' ' ILE . 18.9 t80 -107.52 118.63 37.23 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.447 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.4 mmm -117.61 131.65 56.63 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -87.06 -48.74 7.83 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.586 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -173.15 -62.66 0.02 OUTLIER 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.482 179.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -111.29 -25.29 9.75 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.81 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.628 HD13 ' N ' ' A' ' 50' ' ' SER . 1.1 tm? -101.38 132.22 47.07 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 111.261 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.628 ' N ' HD13 ' A' ' 49' ' ' LEU . 1.0 OUTLIER -97.81 127.62 43.88 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.988 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.471 HD12 ' CD1' ' A' ' 44' ' ' TYR . 22.0 mt -118.11 131.51 70.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.011 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.4 tt -101.31 121.74 42.44 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.807 179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.727 HD12 ' HB3' ' A' ' 42' ' ' LEU . 43.9 mt -79.14 100.64 7.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.65 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.52 -34.99 11.84 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.118 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -141.61 178.52 7.41 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.901 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -32.79 73.65 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.268 179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.1 -47.68 71.52 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.648 0.261 . . . . 0.0 111.145 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -65.59 -46.2 80.31 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.0 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.456 HD13 HD13 ' A' ' 53' ' ' LEU . 10.3 tp -62.71 -42.46 99.65 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.146 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.24 -36.38 81.53 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.066 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.86 -36.48 83.4 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.651 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.549 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -65.22 -36.42 84.1 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.113 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.726 ' CD1' HD21 ' A' ' 75' ' ' LEU . 25.8 mm -64.56 -46.07 93.68 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.121 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.903 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.81 -40.25 69.34 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.267 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.549 HD12 ' HA ' ' A' ' 62' ' ' ALA . 11.7 mt -68.35 -45.63 82.13 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.893 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.3 tp -66.6 -42.62 86.61 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.027 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.85 -42.65 84.9 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.111 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -69.81 -30.4 67.92 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.925 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.5 t -69.2 146.69 52.18 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.817 0.342 . . . . 0.0 111.147 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 67.4 m -75.84 -20.83 57.82 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.617 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 76.1 p -94.43 38.69 1.09 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.792 0.329 . . . . 0.0 111.426 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -79.38 120.64 24.09 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.594 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.35 -68.18 0.19 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.963 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.31 173.19 8.54 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.872 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.726 HD21 ' CD1' ' A' ' 63' ' ' ILE . 5.3 mp -109.24 125.76 52.6 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.12 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 26.9 ttt180 -86.7 107.33 18.17 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.708 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.743 HG21 HD22 ' A' ' 42' ' ' LEU . 28.9 mt -129.7 131.89 66.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.963 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.4 mt -102.03 127.64 48.82 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.817 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.692 HD13 ' CE2' ' A' ' 36' ' ' PHE . 40.0 mt -93.74 119.67 33.02 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.101 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 4.5 mp -144.95 144.89 31.3 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.917 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -80.25 100.01 8.12 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.82 179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -105.36 34.96 3.01 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.629 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -130.01 94.08 3.63 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.892 0.377 . . . . 0.0 110.78 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -126.97 -38.58 2.01 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.155 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -96.25 34.03 1.66 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.662 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -174.24 146.75 1.14 Allowed 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.409 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -156.95 37.27 0.3 Allowed 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.148 179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 -161.66 160.74 29.02 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.65 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.04 47.21 7.54 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.093 0.473 . . . . 0.0 110.702 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.417 ' CE1' ' HB3' ' A' ' 39' ' ' PRO . 1.1 m-70 -70.69 -177.23 1.49 Allowed 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.147 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -78.25 61.49 2.73 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.928 0.394 . . . . 0.0 110.705 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 58.3 87.67 0.07 Allowed 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.375 -179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 4.2 p80 . . . . . 0 C--O 1.252 1.219 0 CA-C-O 118.72 -0.657 . . . . 0.0 111.221 179.679 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 120.842 0.353 . . . . 0.0 111.49 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.485 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 8.1 t -94.14 179.27 5.37 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.549 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.485 ' HB2' ' O ' ' A' ' 2' ' ' SER . 0.8 OUTLIER 71.83 128.28 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.071 -179.865 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.3 t -108.74 139.82 29.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.205 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.61 113.31 25.38 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.225 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.649 HD12 ' CD2' ' A' ' 19' ' ' PHE . 24.0 mt -110.14 123.93 66.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.823 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.418 ' HG3' ' HB3' ' A' ' 74' ' ' SER . 9.0 mttm -95.92 119.94 35.32 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.663 179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.843 ' HB3' HD11 ' A' ' 79' ' ' LEU . 97.8 m-85 -106.58 141.26 38.16 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.098 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -120.82 125.75 48.35 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.126 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.441 ' HB2' HD12 ' A' ' 79' ' ' LEU . 5.6 t-160 -140.65 116.75 10.53 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.603 179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 57.65 32.92 22.57 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.142 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.77 -14.25 60.63 Favored Glycine 0 CA--C 1.525 0.711 0 C-N-CA 120.876 -0.678 . . . . 0.0 113.137 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.76 129.02 34.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.963 0.382 . . . . 0.0 110.859 179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.61 135.01 45.02 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.949 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.7 mtt-85 -139.51 143.95 37.7 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.117 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.423 HD12 ' N ' ' A' ' 16' ' ' ILE . 3.8 mp -116.37 121.25 67.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.94 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 22.2 mm -123.4 136.35 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.347 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -100.22 134.12 43.62 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.011 179.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.649 ' CD2' HD12 ' A' ' 6' ' ' ILE . 81.0 m-85 -128.0 125.87 40.25 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.091 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.2 t -85.56 150.97 24.28 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.97 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -86.62 150.78 51.77 Favored Pre-proline 0 CA--C 1.529 0.173 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.428 179.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.09 127.22 14.61 Favored 'Cis proline' 0 C--N 1.349 0.582 0 C-N-CA 123.573 -1.428 . . . . 0.0 112.752 0.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.5 p -93.07 129.88 42.94 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.057 179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.454 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.4 OUTLIER -100.59 143.63 30.54 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.104 -179.713 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -57.36 -52.58 64.79 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.872 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.03 -35.27 74.73 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.036 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -62.39 -44.77 95.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.719 0.295 . . . . 0.0 110.987 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 24' ' ' LYS . 39.6 t -67.69 -48.43 76.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.52 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -62.75 -36.84 84.36 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.46 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -57.69 -45.03 86.18 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.026 -179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.671 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.6 OUTLIER -61.13 -46.48 90.41 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.776 179.793 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.653 HG11 HD22 ' A' ' 79' ' ' LEU . 33.8 t -61.65 -47.45 93.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.208 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 m -65.69 -38.74 90.09 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.388 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 85.0 m -71.5 -48.48 48.7 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 111.55 0.204 . . . . 0.0 111.55 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.671 HG23 ' O ' ' A' ' 31' ' ' LYS . 59.9 t -61.39 -50.06 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 120.474 0.178 . . . . 0.0 111.36 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.629 ' HE2' HD13 ' A' ' 79' ' ' LEU . 24.4 m-85 -80.74 -20.13 43.43 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 69.47 34.41 73.85 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.802 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.455 ' OE1' ' HB3' ' A' ' 81' ' ' SER . 1.1 pt20 -167.6 149.65 5.33 Favored Pre-proline 0 N--CA 1.464 0.24 0 CA-C-N 116.73 0.265 . . . . 0.0 111.238 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -77.65 126.84 8.44 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.76 2.307 . . . . 0.0 112.709 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.426 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.4 mp -133.79 144.51 49.07 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.919 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.34 130.17 37.23 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.636 179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.42 ' HB2' ' HB2' ' A' ' 53' ' ' LEU . 1.1 mp -81.6 116.74 21.5 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.083 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.412 ' ND1' HD21 ' A' ' 80' ' ' LEU . 3.8 m80 -102.03 121.26 41.83 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.186 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.554 ' HD2' HD11 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -94.62 128.78 41.5 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.794 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.2 ptt? -131.59 114.56 14.99 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.742 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -90.57 -66.01 0.96 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.718 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -146.04 -70.42 0.26 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.409 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -112.46 -16.0 12.98 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.62 179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -110.7 139.78 45.67 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 120.802 0.334 . . . . 0.0 111.253 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 41.1 m -120.77 124.68 45.71 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.598 179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 22.9 mt -114.96 134.44 58.02 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.024 -179.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.432 HD23 ' N ' ' A' ' 53' ' ' LEU . 4.1 tt -92.0 129.37 37.97 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.185 -179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.554 HD11 ' HD2' ' A' ' 44' ' ' TYR . 8.2 mt -82.36 90.44 6.68 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.058 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.4 ttpm? -106.74 -33.67 7.53 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.158 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -117.05 167.08 11.47 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.062 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.36 -37.07 85.92 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.061 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -55.47 -37.59 67.97 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.238 179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.481 ' HB3' HD23 ' A' ' 53' ' ' LEU . 2.0 t70 -65.52 -41.74 92.78 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.672 0.273 . . . . 0.0 110.819 179.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.438 HD12 HD22 ' A' ' 53' ' ' LEU . 0.6 OUTLIER -66.79 -42.29 86.21 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.979 179.73 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -68.79 -41.64 78.47 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.009 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -36.49 81.9 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.818 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.536 ' HB1' ' CZ ' ' A' ' 44' ' ' TYR . . . -64.83 -40.43 95.18 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.369 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 29.0 mt -65.06 -41.44 91.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.035 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -53.41 -44.42 68.73 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.173 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 37.5 mt -68.85 -44.2 81.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.05 179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.48 -43.41 97.38 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.925 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -60.51 -40.45 91.46 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.36 -32.84 73.21 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.16 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.3 t -89.33 107.63 19.17 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.291 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 12.9 t -70.64 -29.03 65.28 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.672 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.5 p -60.71 -61.72 2.38 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.0 ttt -76.32 115.76 16.37 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.767 0.318 . . . . 0.0 111.248 -179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.8 mttm -93.11 -37.02 12.36 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.426 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.418 ' HB3' ' HG3' ' A' ' 7' ' ' LYS . 1.7 m -110.72 166.17 11.23 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.625 0.25 . . . . 0.0 111.108 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.637 ' CD1' HG23 ' A' ' 6' ' ' ILE . 0.3 OUTLIER -116.86 136.7 52.75 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.107 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.435 ' O ' HD13 ' A' ' 77' ' ' ILE . 3.5 mtp85 -86.32 116.59 24.58 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.158 -179.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.607 HD11 HD12 ' A' ' 75' ' ' LEU . 24.2 mm -126.65 129.84 71.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.151 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.227 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.3 mp -102.15 125.67 48.9 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.607 179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.843 HD11 ' HB3' ' A' ' 8' ' ' PHE . 2.0 mt -98.08 129.44 44.91 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.089 -179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.412 HD21 ' ND1' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -149.62 135.41 18.65 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.253 179.822 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.455 ' HB3' ' OE1' ' A' ' 38' ' ' GLN . 81.6 p -85.69 131.07 34.4 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.456 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.55 35.87 1.74 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.732 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.8 p-10 -157.37 85.74 0.93 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.046 0.45 . . . . 0.0 111.062 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.45 -5.96 45.56 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.607 179.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -66.27 81.69 0.09 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 121.084 0.469 . . . . 0.0 111.288 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -173.93 169.9 3.98 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.175 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -121.65 143.08 49.53 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.943 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -107.18 -34.73 7.04 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.019 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.71 -177.19 0.18 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 120.702 0.287 . . . . 0.0 111.19 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -80.83 92.6 6.12 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.914 0.388 . . . . 0.0 110.538 -179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -109.51 -179.62 3.87 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.28 -179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -104.81 142.7 34.26 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.208 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.553 -0.737 . . . . 0.0 111.084 179.636 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 . . . . . 0 N--CA 1.489 1.506 0 CA-C-O 120.639 0.257 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.4 p -169.52 78.93 0.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.42 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -162.83 104.25 1.03 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.143 -179.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -98.93 131.66 45.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.034 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.43 ' HE ' HG21 ' A' ' 16' ' ' ILE . 7.2 ttt180 -90.16 105.56 17.89 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.893 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.629 HG23 ' HB2' ' A' ' 75' ' ' LEU . 1.9 mp -111.15 135.13 51.25 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.056 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -104.25 121.23 42.87 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.698 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.518 ' HD2' HD11 ' A' ' 79' ' ' LEU . 11.3 m-85 -99.85 142.24 31.59 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.084 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -131.69 125.54 32.33 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 11.1 t-80 -148.86 117.67 6.66 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.686 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 58.0 31.47 20.68 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.456 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.87 -14.44 58.62 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.087 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -85.08 106.98 16.95 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 117.013 0.406 . . . . 0.0 110.378 179.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 8' ' ' PHE . 0.0 OUTLIER -101.21 144.07 30.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.013 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -143.01 157.94 44.07 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.364 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.43 HG21 ' HE ' ' A' ' 5' ' ' ARG . 3.8 mp -115.98 123.07 70.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.821 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 30.9 mt -130.86 138.63 53.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.181 179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.24 133.97 34.59 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.125 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -128.13 117.63 21.96 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.901 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 97.6 p -76.21 145.89 39.46 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.126 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -98.91 154.52 37.32 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.032 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.34 120.71 7.14 Favored 'Cis proline' 0 C--N 1.351 0.704 0 C-N-CA 123.335 -1.527 . . . . 0.0 112.796 0.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.9 p -75.57 129.46 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.266 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.422 ' O ' HG23 ' A' ' 28' ' ' VAL . 0.0 OUTLIER -97.73 139.29 33.82 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.973 -179.941 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -55.31 -44.25 75.62 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.765 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.71 -41.15 94.66 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.924 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.4 -44.44 96.43 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.116 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 24' ' ' LYS . 22.2 t -65.88 -48.63 81.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.823 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -58.44 -39.97 81.3 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.241 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -58.0 -40.24 80.25 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.754 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.68 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.4 OUTLIER -68.54 -48.13 65.11 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.993 179.515 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 28' ' ' VAL . 23.2 t -60.02 -42.62 90.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.344 -179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 28.6 m -61.37 -39.0 89.04 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.924 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.9 m -71.49 -46.98 58.34 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 111.47 0.174 . . . . 0.0 111.47 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.68 HG23 ' O ' ' A' ' 31' ' ' LYS . 36.8 t -58.27 -50.05 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -179.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.474 ' CE2' HD13 ' A' ' 79' ' ' LEU . 24.9 m-85 -83.6 -24.67 31.39 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.17 28.25 58.59 Favored Glycine 0 CA--C 1.523 0.549 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.848 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.503 ' O ' HD12 ' A' ' 40' ' ' LEU . 1.5 pt20 -173.08 159.63 3.49 Favored Pre-proline 0 N--CA 1.464 0.226 0 CA-C-N 116.712 0.256 . . . . 0.0 110.973 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.433 ' HD2' ' HB2' ' A' ' 38' ' ' GLN . 56.3 Cg_endo -71.23 109.73 2.66 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.631 2.221 . . . . 0.0 112.524 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.503 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.9 mp -115.59 154.82 28.74 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.091 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -98.17 141.9 30.52 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.779 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.443 ' N ' HD23 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -108.49 100.06 9.38 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.695 179.783 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.0 m170 -92.14 131.04 37.7 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.418 -179.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 15.7 t80 -107.03 121.94 45.46 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.486 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 7.7 mmt -109.32 114.75 28.69 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.62 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.8 t-20 -72.3 -56.58 5.26 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.734 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -170.77 -58.6 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.574 179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -117.44 2.57 12.45 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.676 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.709 HD12 HD11 ' A' ' 51' ' ' ILE . 0.5 OUTLIER -131.76 159.59 38.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.784 0.326 . . . . 0.0 111.659 -179.851 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.87 125.08 49.84 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.262 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.709 HD11 HD12 ' A' ' 49' ' ' LEU . 28.0 mm -116.14 132.11 66.63 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.851 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -96.33 126.82 41.8 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.817 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.496 HD21 ' HA ' ' A' ' 59' ' ' LEU . 7.0 mt -87.56 92.11 8.98 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.761 0.315 . . . . 0.0 110.764 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.9 pttt -107.46 -34.38 7.07 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.416 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -131.54 171.04 13.9 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.712 0.291 . . . . 0.0 111.033 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.05 -31.54 71.19 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.922 179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -54.09 -44.77 71.5 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 120.664 0.269 . . . . 0.0 111.029 179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.446 ' HB2' HD23 ' A' ' 53' ' ' LEU . 61.1 m-20 -67.21 -36.76 82.4 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.809 179.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.496 ' HA ' HD21 ' A' ' 53' ' ' LEU . 1.3 tp -68.86 -41.85 77.87 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.095 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.58 -41.1 96.92 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.066 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -62.99 -39.21 94.07 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.847 179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.3 -43.67 97.17 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.078 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 43.9 mm -65.37 -41.49 91.34 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.139 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.826 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.48 -43.26 75.38 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.971 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.0 mt -67.83 -42.44 85.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.881 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.9 tp -67.36 -39.23 85.69 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.399 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.57 -37.51 86.45 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.695 0.283 . . . . 0.0 110.924 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -32.37 62.78 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.511 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.3 p -78.48 119.45 21.8 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.03 0.443 . . . . 0.0 111.162 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.49 -29.5 56.85 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.674 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.1 p -93.67 34.58 1.18 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 120.634 0.254 . . . . 0.0 111.678 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.5 mtm -149.98 123.21 8.93 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.667 0.27 . . . . 0.0 111.022 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.55 -46.97 2.35 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.684 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.1 t -83.65 174.09 10.81 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.951 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.629 ' HB2' HG23 ' A' ' 6' ' ' ILE . 2.3 mp -119.07 135.29 54.72 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.903 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 41.9 mtt85 -102.0 107.49 18.63 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.727 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 9.0 mt -129.58 131.79 66.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.868 -179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 mp -102.07 119.48 38.86 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.604 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.518 HD11 ' HD2' ' A' ' 8' ' ' PHE . 2.6 mt -93.42 129.44 39.57 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.116 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mp -138.58 134.95 34.47 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.086 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -72.13 161.39 30.95 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.96 179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 64.11 75.87 0.37 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.682 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -71.99 179.83 3.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.372 -179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 11.1 mtt180 60.34 72.24 0.53 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.117 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.09 119.73 30.68 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.957 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.64 147.84 50.51 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.324 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -56.3 -35.27 67.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.117 179.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -118.69 60.49 0.8 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.826 0.346 . . . . 0.0 111.11 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -63.39 -56.86 12.82 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.658 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 65.62 106.04 0.04 OUTLIER 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.862 179.418 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -160.86 156.89 25.73 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.557 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -162.22 142.16 9.86 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.811 179.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 24.0 m80 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.043 -0.98 . . . . 0.0 111.36 -179.717 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 120.499 0.19 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 65.26 172.39 0.21 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.363 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 58.41 95.03 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.126 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -75.46 143.68 12.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.075 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.4 mtp85 -95.36 114.65 26.44 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.769 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.729 HD13 ' HD2' ' A' ' 19' ' ' PHE . 4.6 mp -115.4 134.74 57.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.269 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -100.69 127.47 47.09 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.785 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -107.46 138.46 43.63 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.059 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -130.47 124.18 31.41 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.105 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.54 ' HB2' HD12 ' A' ' 79' ' ' LEU . 1.9 t-160 -147.06 127.91 14.42 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.633 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.08 27.68 16.71 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.489 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.45 -13.98 60.78 Favored Glycine 0 CA--C 1.526 0.728 0 C-N-CA 120.88 -0.676 . . . . 0.0 113.13 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -83.04 163.44 20.96 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 117.004 0.402 . . . . 0.0 111.119 179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 58.1 mtt180 -120.65 153.03 37.42 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.251 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.1 141.15 28.55 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.02 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.9 mt -111.73 119.02 59.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.877 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.16 130.34 34.24 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 120.925 0.393 . . . . 0.0 111.218 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -99.57 135.68 40.62 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.055 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.729 ' HD2' HD13 ' A' ' 6' ' ' ILE . 39.2 m-85 -122.93 126.65 47.65 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.11 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.3 m -72.63 138.56 46.81 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.015 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.26 152.68 38.71 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.964 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.2 132.31 26.89 Favored 'Cis proline' 0 C--N 1.349 0.594 0 C-N-CA 123.275 -1.552 . . . . 0.0 112.726 0.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.4 p -110.65 130.45 63.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.118 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.71 144.91 25.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.014 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -54.71 -37.4 65.81 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.193 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -59.35 -45.07 92.41 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.046 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -63.47 -44.21 95.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.105 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.494 ' O ' HG23 ' A' ' 32' ' ' VAL . 22.4 t -65.43 -48.82 81.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.891 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.3 tt0 -56.68 -41.42 77.29 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.839 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -57.67 -42.32 83.33 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.737 179.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.642 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -66.8 -47.64 71.47 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.131 179.595 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 28' ' ' VAL . 25.5 t -57.53 -45.65 86.05 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.138 -179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.9 m -62.66 -38.78 91.67 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.087 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.3 m -71.48 -46.91 58.59 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.3 t -60.68 -49.92 82.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 N-CA-C 111.553 0.205 . . . . 0.0 111.553 -179.354 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.702 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 35.4 m-85 -83.84 -21.96 31.87 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 97.54 -16.74 60.09 Favored Glycine 0 CA--C 1.525 0.678 0 C-N-CA 120.735 -0.745 . . . . 0.0 113.06 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.607 ' O ' HD12 ' A' ' 40' ' ' LEU . 11.5 pt20 -146.11 158.0 49.0 Favored Pre-proline 0 CA--C 1.531 0.227 0 CA-C-N 116.846 0.323 . . . . 0.0 110.758 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.99 129.61 14.46 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.573 2.182 . . . . 0.0 112.489 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.607 HD12 ' O ' ' A' ' 38' ' ' GLN . 4.7 mp -120.86 151.91 39.06 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.36 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -87.24 137.64 32.17 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.611 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.522 HD22 HG21 ' A' ' 77' ' ' ILE . 3.1 mt -98.76 107.03 19.37 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.942 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.457 ' CE1' HD13 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -93.75 114.89 27.27 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.048 -179.716 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -95.12 129.07 42.36 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 21.8 ptm -127.11 121.63 31.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.712 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -86.34 -60.05 2.11 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.358 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -154.12 -67.97 0.14 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.273 179.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.59 -21.39 12.15 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.683 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mp -104.65 140.38 38.12 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.768 0.318 . . . . 0.0 111.311 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -113.91 122.36 46.75 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.827 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 18.5 mt -113.95 132.52 62.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.83 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.457 HD13 ' CE1' ' A' ' 43' ' ' HIS . 31.2 tp -93.3 134.84 35.1 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.759 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 56.1 mt -87.37 107.57 18.59 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.997 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.57 -35.72 6.38 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.306 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.9 p30 -136.87 180.0 6.04 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.39 -179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.405 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 4.8 tp60 -64.32 -34.33 77.88 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.122 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.04 -40.35 73.36 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.796 -0.183 . . . . 0.0 111.283 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -66.36 -50.02 64.96 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.422 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.466 HD12 ' N ' ' A' ' 60' ' ' ASP . 3.9 pp -69.79 -34.38 73.65 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.968 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.78 ' HA ' HD12 ' A' ' 63' ' ' ILE . 27.2 t0 -61.31 -43.76 98.33 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.62 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -70.22 -32.75 70.77 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.07 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.821 ' HA ' HD12 ' A' ' 65' ' ' ILE . . . -63.81 -39.32 93.94 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.319 179.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.78 HD12 ' HA ' ' A' ' 60' ' ' ASP . 5.8 mt -61.08 -47.37 93.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.736 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -53.18 -37.32 61.81 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.157 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.821 HD12 ' HA ' ' A' ' 62' ' ' ALA . 17.0 mt -64.91 -38.38 82.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.067 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.52 HD11 ' HG ' ' A' ' 75' ' ' LEU . 14.5 mt -66.55 -46.99 74.26 Favored 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.984 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.12 -38.16 85.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.199 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -28.74 67.91 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.47 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.1 p -62.44 165.83 5.74 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-O 120.956 0.407 . . . . 0.0 111.519 -179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.88 -43.16 18.56 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.198 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 57.6 p -127.62 -35.06 2.16 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -179.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -50.45 91.45 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.181 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -106.73 -32.35 8.02 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.168 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 64.6 p -69.12 -179.85 1.68 Allowed 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.63 0.252 . . . . 0.0 111.09 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.553 ' HB3' HD11 ' A' ' 77' ' ' ILE . 3.1 mp -129.69 117.64 20.65 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.723 0.297 . . . . 0.0 111.525 -179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -86.89 106.89 18.08 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.246 179.356 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.553 HD11 ' HB3' ' A' ' 75' ' ' LEU . 2.6 mt -129.78 130.8 66.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.111 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -103.9 129.61 51.44 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.578 179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.702 HD13 ' CZ ' ' A' ' 36' ' ' PHE . 4.9 mt -93.63 129.11 40.02 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.25 -179.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.419 HD12 ' C ' ' A' ' 79' ' ' LEU . 5.8 mp -138.3 134.08 33.86 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.072 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.7 m -63.18 115.42 4.48 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.297 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -112.66 33.36 5.02 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.305 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.87 54.45 2.43 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.035 0.445 . . . . 0.0 110.871 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -117.19 -42.59 2.9 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.007 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -86.02 111.43 20.29 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.106 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 2.1 mt -107.44 -39.6 5.6 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.29 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 67.41 101.96 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 122.671 0.388 . . . . 0.0 111.602 179.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.438 ' O ' ' HB2' ' A' ' 89' ' ' HIS . 0.1 OUTLIER -107.56 -173.88 2.39 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.17 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.438 ' HB2' ' O ' ' A' ' 88' ' ' HIS . 39.8 m-70 70.4 175.54 0.29 Allowed 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 -179.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 13.8 p80 -59.36 -31.34 69.12 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.11 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.68 127.0 29.33 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.121 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 63.75 89.45 0.09 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.355 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 12.3 t-160 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.164 -0.922 . . . . 0.0 110.755 179.987 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 120.551 0.215 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 m -164.39 81.85 0.4 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.784 0.326 . . . . 0.0 111.162 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -170.94 114.89 0.43 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.772 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.28 138.99 52.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.148 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.61 113.73 25.22 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.031 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.481 HD12 ' CD2' ' A' ' 19' ' ' PHE . 21.3 mt -104.93 117.44 50.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.974 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -98.41 127.16 44.22 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.022 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.753 ' CD1' HD12 ' A' ' 17' ' ' ILE . 33.5 m-85 -110.71 147.87 33.48 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.025 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -129.56 132.76 46.91 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.223 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.449 ' HB2' HD11 ' A' ' 79' ' ' LEU . 12.3 t-80 -148.19 112.97 5.41 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.812 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 56.39 36.74 28.02 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.396 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.43 -13.96 62.42 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.218 -179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -84.34 122.01 28.33 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.984 0.392 . . . . 0.0 110.812 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -105.38 146.03 29.99 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.135 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -146.57 138.51 24.76 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.136 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.2 mp -105.75 122.1 58.84 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.999 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.753 HD12 ' CD1' ' A' ' 8' ' ' PHE . 6.1 mt -126.27 127.45 70.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.923 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.3 140.76 29.38 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.315 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.481 ' CD2' HD12 ' A' ' 6' ' ' ILE . 8.0 m-85 -137.35 119.85 15.97 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.76 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.0 m -75.63 134.62 40.59 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.081 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.401 ' HA ' ' N ' ' A' ' 23' ' ' VAL . 7.3 mtm180 -75.77 150.42 83.98 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.226 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.06 120.76 7.33 Favored 'Cis proline' 0 C--N 1.349 0.577 0 C-N-CA 123.284 -1.549 . . . . 0.0 112.283 -0.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.401 ' N ' ' HA ' ' A' ' 21' ' ' ARG . 12.6 p -73.77 127.66 35.76 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.983 0.42 . . . . 0.0 110.993 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.97 130.57 46.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.945 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -55.87 -35.99 67.09 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.997 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.19 -44.49 96.49 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.152 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -66.26 -44.8 82.63 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.703 0.287 . . . . 0.0 111.006 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.1 t -67.16 -46.51 84.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.95 179.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -61.4 -42.51 98.84 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.304 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -58.16 -41.87 84.73 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.011 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.776 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -61.14 -46.98 88.31 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.881 179.602 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.0 t -66.25 -45.55 89.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.12 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.1 m -60.09 -38.71 83.74 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.1 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 59.7 m -70.61 -43.58 69.02 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 111.592 0.219 . . . . 0.0 111.592 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.776 HG23 ' O ' ' A' ' 31' ' ' LYS . 62.1 t -58.47 -49.87 80.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-O 120.526 0.203 . . . . 0.0 111.311 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -83.7 -28.13 28.51 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 84.04 28.49 34.1 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.668 -179.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.588 ' O ' HD12 ' A' ' 40' ' ' LEU . 8.9 pt20 -168.94 158.4 7.72 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-O 120.535 0.207 . . . . 0.0 110.899 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -71.03 124.7 10.79 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.943 2.429 . . . . 0.0 112.217 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.627 HD22 HD13 ' A' ' 79' ' ' LEU . 4.0 mp -117.21 151.54 36.68 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.175 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.25 120.99 40.75 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.928 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.633 HD23 HG21 ' A' ' 77' ' ' ILE . 4.0 mp -83.52 125.88 32.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.13 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -113.67 115.57 28.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.83 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -111.67 121.85 46.22 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.696 179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -115.52 133.27 56.19 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.757 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -74.17 -56.18 5.21 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.77 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -170.04 -57.57 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.39 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -104.64 -30.32 10.04 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.316 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.6 mt -108.89 145.31 35.57 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.968 0.413 . . . . 0.0 111.389 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 30.2 t -109.78 127.98 55.0 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.952 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.9 mt -118.42 134.44 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.978 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.602 HD22 ' HG2' ' A' ' 54' ' ' LYS . 2.1 tt -90.69 128.98 36.83 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.841 179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.569 HD12 ' HB3' ' A' ' 42' ' ' LEU . 47.5 mt -81.33 96.96 7.48 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.962 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.602 ' HG2' HD22 ' A' ' 52' ' ' LEU . 5.9 mmtp -108.72 -37.85 5.79 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.226 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -125.96 175.81 7.43 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.099 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.411 ' O ' ' HG ' ' A' ' 59' ' ' LEU . 2.6 mt-30 -62.97 -32.63 74.01 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.904 179.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.25 -39.12 72.07 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.353 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.482 ' HB3' HD23 ' A' ' 53' ' ' LEU . 9.2 m-20 -64.16 -50.43 68.2 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.495 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.421 ' C ' HD12 ' A' ' 59' ' ' LEU . 3.6 pp -71.75 -34.45 69.51 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.086 -0.246 . . . . 0.0 110.926 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -63.01 -43.25 99.29 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.786 0.326 . . . . 0.0 111.027 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -33.26 73.71 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.91 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.01 -41.96 99.69 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.257 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.639 ' HA ' HD12 ' A' ' 66' ' ' LEU . 16.0 mt -63.88 -42.58 96.31 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.14 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.737 179.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -54.35 -41.83 69.55 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.872 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 29.2 mt -66.7 -41.04 87.48 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.983 179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.715 HD13 HD11 ' A' ' 75' ' ' LEU . 6.0 mt -65.19 -40.32 94.07 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.113 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -66.75 -32.02 73.04 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.171 179.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -33.77 76.57 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.48 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.7 t -104.76 134.22 48.27 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.452 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 94.3 p -77.33 -37.29 52.76 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.989 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.5 p -63.27 -35.85 81.7 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.135 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.07 121.49 27.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.698 0.285 . . . . 0.0 111.068 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.0 mmmt -132.17 -52.61 0.96 Allowed 'General case' 0 CA--C 1.529 0.149 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.996 179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 1.2 m -70.01 177.94 2.95 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.134 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.715 HD11 HD13 ' A' ' 66' ' ' LEU . 1.1 mp -131.9 119.03 20.61 Favored 'General case' 0 C--O 1.23 0.068 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.157 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.3 tpt180 -96.65 107.02 19.39 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.32 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.633 HG21 HD23 ' A' ' 42' ' ' LEU . 29.5 mt -128.69 132.19 67.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.904 -179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.6 mp -102.08 130.72 48.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.626 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.627 HD13 HD22 ' A' ' 40' ' ' LEU . 2.0 pp -117.86 136.05 53.7 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.958 0.409 . . . . 0.0 111.215 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.7 mp -137.74 158.45 44.34 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.944 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.9 t -59.02 110.34 1.02 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.099 179.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 11.3 tp60 -109.99 39.15 2.21 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.167 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -106.99 32.82 4.31 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 120.711 0.291 . . . . 0.0 110.933 179.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 65.04 21.9 12.32 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.312 -179.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 71.48 141.82 0.05 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.99 0.424 . . . . 0.0 111.623 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.0 tp -139.38 37.74 2.07 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.395 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 51.56 75.48 0.2 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.632 179.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -138.46 80.46 1.79 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 0.0 110.922 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 30.6 m80 -122.82 -49.51 1.98 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.883 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 33.6 p-80 -161.85 89.61 0.74 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-O 120.932 0.396 . . . . 0.0 111.386 179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -165.45 126.72 1.96 Allowed 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.157 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 46.2 m80 -83.73 -180.0 7.45 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.719 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.115 -0.945 . . . . 0.0 111.444 -179.764 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 120.831 0.348 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.45 179.94 5.28 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.812 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 68.56 101.5 0.05 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.236 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.407 ' O ' HD12 ' A' ' 6' ' ' ILE . 22.2 t -101.56 129.33 52.88 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.783 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -90.6 105.58 17.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.056 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.518 HD13 ' HD2' ' A' ' 19' ' ' PHE . 3.5 mp -114.99 129.07 71.8 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.208 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 9.4 mtpt -100.34 126.81 46.73 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.634 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.485 ' HB3' HD11 ' A' ' 79' ' ' LEU . 48.7 m-85 -114.89 127.56 55.77 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.022 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -122.0 131.2 53.87 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.217 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -145.5 128.73 16.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.694 179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.73 30.67 20.25 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.221 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 87.96 -13.96 59.95 Favored Glycine 0 CA--C 1.524 0.632 0 C-N-CA 120.982 -0.628 . . . . 0.0 113.065 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -90.33 116.57 28.4 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 117.001 0.401 . . . . 0.0 110.848 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -104.93 135.87 45.48 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.233 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -134.2 154.27 51.35 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.248 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.413 ' O ' HD13 ' A' ' 17' ' ' ILE . 7.4 mt -115.31 122.25 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.344 -179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.413 HD13 ' O ' ' A' ' 16' ' ' ILE . 26.4 mm -127.49 128.66 70.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.145 179.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -89.91 129.05 36.32 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.694 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.518 ' HD2' HD13 ' A' ' 6' ' ' ILE . 11.9 m-85 -117.34 117.61 29.99 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.386 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.02 157.14 38.07 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.173 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.556 ' NH2' HG21 ' A' ' 63' ' ' ILE . 5.9 mmt180 -99.84 151.31 37.44 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.469 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -76.35 145.11 81.25 Favored 'Cis proline' 0 C--N 1.35 0.608 0 C-N-CA 123.414 -1.494 . . . . 0.0 112.801 0.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.6 p -107.42 124.49 63.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.106 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' O ' HG23 ' A' ' 28' ' ' VAL . 18.7 mmtm -102.56 149.88 23.97 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.236 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -58.11 -48.17 81.03 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.757 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.35 -42.28 95.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.227 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -62.08 -44.33 96.9 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.059 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' ' 24' ' ' LYS . 38.3 t -68.83 -48.72 69.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.785 179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -40.06 84.62 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.2 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -58.18 -39.89 80.07 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.816 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -70.97 -41.03 71.57 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.752 179.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' ' 28' ' ' VAL . 37.8 t -66.64 -42.58 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.186 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.7 t -65.71 -38.5 89.36 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.146 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.9 m -71.31 -46.79 59.85 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.436 HG13 ' N ' ' A' ' 36' ' ' PHE . 13.4 p -60.38 -47.95 90.36 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 -179.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.661 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 33.1 m-85 -84.08 -18.09 38.08 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 111.828 0.307 . . . . 0.0 111.828 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 79.43 22.63 64.46 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 120.865 -0.683 . . . . 0.0 113.118 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.518 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -172.26 149.87 2.22 Favored Pre-proline 0 N--CA 1.463 0.216 0 CA-C-N 116.863 0.331 . . . . 0.0 110.94 179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -74.23 106.9 2.32 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.569 2.179 . . . . 0.0 112.125 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.518 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.2 mp -104.87 140.04 38.73 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.96 -179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.47 140.75 41.36 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.017 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.661 ' HB2' HD12 ' A' ' 53' ' ' LEU . 3.3 mp -101.95 118.52 37.08 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.062 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -105.3 129.69 53.59 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.299 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -109.79 129.01 55.67 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.656 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 14.1 mtt -125.48 132.41 52.66 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.682 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -97.61 -65.83 0.94 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.686 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -144.87 -71.51 0.27 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.442 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -111.58 -18.23 12.86 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.527 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.3 mp -105.63 139.96 39.43 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.803 0.335 . . . . 0.0 111.35 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.8 m -114.03 125.8 54.4 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.828 179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.1 mt -114.0 132.54 62.72 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.099 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.644 HD22 ' HE2' ' A' ' 54' ' ' LYS . 8.6 tt -92.38 128.08 38.1 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.8 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.834 HD13 HD21 ' A' ' 59' ' ' LEU . 71.9 mt -71.51 100.03 2.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.564 179.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.644 ' HE2' HD22 ' A' ' 52' ' ' LEU . 5.5 mmtt -90.2 -49.25 6.66 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.424 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -149.06 -170.2 3.57 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.869 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.69 -32.34 65.34 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.255 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -53.76 -45.66 70.69 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.849 0.357 . . . . 0.0 110.799 179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.03 -42.69 84.43 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.166 179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.834 HD21 HD13 ' A' ' 53' ' ' LEU . 77.5 mt -67.82 -40.53 83.78 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.272 179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.776 ' HA ' HD12 ' A' ' 63' ' ' ILE . 3.0 t0 -61.66 -43.46 98.81 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.06 -179.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 mmtp -63.39 -39.4 94.41 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.388 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.48 -41.64 98.93 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.188 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.776 HD12 ' HA ' ' A' ' 60' ' ' ASP . 6.2 mt -63.78 -45.73 96.4 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 116.661 -0.245 . . . . 0.0 110.883 179.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.83 -44.85 78.32 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.041 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 9.3 mt -67.09 -39.48 83.32 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.989 179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.857 HD22 HD21 ' A' ' 75' ' ' LEU . 9.4 tp -61.99 -45.45 93.59 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.057 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -56.92 -37.24 71.2 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.256 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -33.24 64.62 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.101 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 6.3 t -89.07 92.68 9.31 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.256 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 40.6 t -62.99 -34.75 78.2 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.054 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.06 -33.78 67.6 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.318 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.96 129.42 42.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.097 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 47.5 mttt -111.71 -44.69 3.45 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.887 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.472 ' C ' HD22 ' A' ' 75' ' ' LEU . 60.5 p -101.62 179.04 4.46 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.187 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.857 HD21 HD22 ' A' ' 66' ' ' LEU . 4.0 mm? -123.25 128.93 50.68 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.062 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -88.47 108.57 19.45 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.654 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.9 mt -127.26 131.3 70.69 Favored 'Isoleucine or valine' 0 C--O 1.232 0.168 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.189 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 7.7 mp -102.02 128.29 48.52 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.699 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.661 HD13 ' CZ ' ' A' ' 36' ' ' PHE . 2.5 mt -94.02 122.35 36.43 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.148 -179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.1 mp -134.1 134.24 42.04 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.114 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.2 m -68.64 124.18 22.91 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.996 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -143.76 62.63 1.36 Allowed 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.068 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -99.65 44.94 1.0 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.765 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.6 mtp180 -102.73 32.09 3.82 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.852 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -157.23 172.14 19.16 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.719 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 5.2 mp -97.24 -82.12 0.41 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.852 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 173.94 -176.53 0.08 Allowed 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 122.321 0.248 . . . . 0.0 110.496 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -116.42 93.99 4.45 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.797 0.332 . . . . 0.0 110.944 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.04 135.57 17.07 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.239 -179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -172.42 96.65 0.15 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.225 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 48.2 t-80 -97.39 -38.26 9.69 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.105 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -117.38 -67.03 1.02 Allowed 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.656 -0.247 . . . . 0.0 110.905 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 1.3 t60 . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.897 -179.949 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 120.691 0.282 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m -106.32 131.05 54.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.068 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 68.41 110.57 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.673 0.608 . . . . 0.0 111.342 -179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.4 t -99.59 131.58 46.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.208 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -88.96 119.93 29.92 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.746 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 17.5 mt -115.66 133.63 61.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.192 -179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.8 mttp -99.43 125.0 45.07 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.834 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -114.11 137.22 52.02 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.182 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.48 133.36 55.42 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.392 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.9 t-80 -146.13 116.8 7.62 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.265 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 14.9 m-20 57.97 33.99 23.8 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.391 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.24 13.31 80.98 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 121.029 -0.605 . . . . 0.0 113.348 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -109.49 120.36 42.27 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 117.237 0.519 . . . . 0.0 110.518 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.9 mtt-85 -92.75 135.21 34.31 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.978 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.38 143.39 50.74 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.036 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.422 ' O ' HD13 ' A' ' 17' ' ' ILE . 3.6 mt -110.12 116.02 51.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.199 -179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.422 HD13 ' O ' ' A' ' 16' ' ' ILE . 26.3 mm -128.36 131.46 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.046 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.47 129.88 36.59 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.007 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -127.15 118.38 24.23 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.934 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.95 145.08 34.21 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.972 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -99.85 149.56 36.06 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.171 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.77 121.65 7.95 Favored 'Cis proline' 0 C--N 1.35 0.655 0 C-N-CA 123.361 -1.516 . . . . 0.0 112.899 0.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.7 p -89.86 130.48 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.855 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -84.09 138.25 33.14 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.126 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -55.99 -45.04 79.13 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.234 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.57 -39.62 80.82 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.938 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -63.4 -44.59 94.24 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.047 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.489 ' O ' HG23 ' A' ' 32' ' ' VAL . 21.5 t -67.87 -48.88 73.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.016 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -41.18 96.08 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.503 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -45.39 87.38 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.766 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.651 ' O ' HG23 ' A' ' 35' ' ' VAL . 1.4 tptm -61.59 -47.58 84.84 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.769 179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.58 HG11 HD22 ' A' ' 79' ' ' LEU . 39.1 t -58.93 -48.9 84.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-O 120.668 0.271 . . . . 0.0 110.964 179.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 53.4 m -64.28 -39.03 93.11 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.472 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.3 m -71.82 -48.19 48.01 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 31' ' ' LYS . 65.5 t -60.85 -48.83 87.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 N-CA-C 111.645 0.239 . . . . 0.0 111.645 -179.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.439 ' CE2' HD13 ' A' ' 79' ' ' LEU . 52.5 m-85 -83.28 -22.09 33.11 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.67 -7.73 81.13 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 120.887 -0.673 . . . . 0.0 113.34 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.669 ' O ' HD12 ' A' ' 40' ' ' LEU . 16.1 mt-30 -131.67 145.57 58.09 Favored Pre-proline 0 CA--C 1.529 0.152 0 CA-C-N 117.279 0.539 . . . . 0.0 110.984 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -75.06 94.4 0.96 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.57 2.18 . . . . 0.0 112.211 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.669 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.6 mp -94.68 135.98 35.52 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.888 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.577 ' CG ' HD11 ' A' ' 52' ' ' LEU . 0.7 OUTLIER -76.16 140.47 41.75 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.962 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 mt -87.3 100.19 12.53 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.596 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.521 ' CE1' HD13 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -95.44 117.76 30.95 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.497 -179.382 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -107.07 115.94 31.06 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.361 179.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 1.4 ptm -101.3 134.88 43.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.77 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -89.62 -45.46 9.34 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.87 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -173.16 -68.36 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.43 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 35.9 mm-40 -108.99 -24.5 11.18 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.505 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 mp -105.03 137.94 42.0 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 120.789 0.328 . . . . 0.0 111.302 -179.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 p -95.62 124.42 39.64 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.596 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.8 mp -113.7 134.37 56.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.165 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.735 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.577 HD11 ' CG ' ' A' ' 41' ' ' ASP . 14.0 tp -102.74 130.84 49.82 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.743 0.306 . . . . 0.0 110.957 -179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.467 HD21 ' HA ' ' A' ' 59' ' ' LEU . 8.1 mt -78.07 93.35 4.49 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.852 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -93.15 -37.46 12.1 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.155 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 62.2 m-20 -134.83 171.55 14.22 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.835 0.35 . . . . 0.0 111.337 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.1 tp60 -60.72 -31.61 70.9 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.363 179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -52.97 -45.86 67.99 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.773 0.321 . . . . 0.0 110.506 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.439 ' HB3' HD23 ' A' ' 53' ' ' LEU . 0.5 OUTLIER -63.16 -39.47 94.76 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.239 179.591 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.467 ' HA ' HD21 ' A' ' 53' ' ' LEU . 17.7 tp -66.29 -42.98 87.58 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.143 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.596 ' HA ' HD12 ' A' ' 63' ' ' ILE . 3.3 m-20 -61.49 -43.12 99.43 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.836 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.66 -40.63 97.68 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.469 179.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.42 -42.93 99.81 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.666 179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.596 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.7 mt -63.3 -44.17 99.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 120.521 0.2 . . . . 0.0 110.834 179.801 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -55.79 -43.73 77.1 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.253 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 17.6 mt -68.87 -41.74 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.933 179.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.478 HD13 ' HG ' ' A' ' 75' ' ' LEU . 1.5 tp -60.68 -45.05 95.64 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.012 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -58.62 -41.74 86.63 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.996 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.0 ttp85 -71.29 -33.57 69.84 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.611 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 89.2 p -82.57 103.03 11.8 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.847 0.356 . . . . 0.0 111.284 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 59.8 m -77.91 -38.2 46.2 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.281 179.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.8 p -61.96 -33.22 73.88 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.607 0.241 . . . . 0.0 111.562 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.0 tpt -63.17 150.29 43.27 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.99 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -127.34 105.25 8.41 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.705 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.9 m 66.04 -178.56 0.19 Allowed 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.097 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.478 ' HG ' HD13 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -98.84 123.42 43.08 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.95 -179.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.33 107.14 18.99 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 120.835 0.35 . . . . 0.0 110.633 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.6 mt -128.1 131.16 69.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.805 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -102.0 124.65 47.98 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.555 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.58 HD22 HG11 ' A' ' 32' ' ' VAL . 14.5 mt -93.63 133.28 37.13 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.211 -179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.439 HD21 ' ND1' ' A' ' 43' ' ' HIS . 0.4 OUTLIER -140.21 136.16 33.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.367 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.73 151.84 46.64 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.492 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.33 33.28 5.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.568 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.79 141.69 2.32 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.582 0.23 . . . . 0.0 111.137 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.18 67.32 1.86 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.985 0.422 . . . . 0.0 111.032 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -148.74 78.31 1.4 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.786 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.606 HD22 HE22 ' A' ' 38' ' ' GLN . 0.6 OUTLIER -155.8 42.06 0.41 Allowed 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.155 179.836 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -150.1 -61.13 0.2 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.806 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -87.94 102.49 14.77 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.743 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -156.73 132.04 9.24 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.305 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -109.88 -37.91 5.5 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.256 179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -85.93 120.38 27.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.609 0.242 . . . . 0.0 110.795 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -87.17 -179.67 6.49 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.012 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.696 -179.908 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.9 m -158.72 158.21 33.23 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.422 0.153 . . . . 0.0 110.784 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 57.89 87.85 0.06 Allowed 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.222 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -87.18 135.31 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.263 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.2 mtm-85 -92.93 124.5 36.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.913 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.508 HD12 ' HD1' ' A' ' 19' ' ' PHE . 2.8 mt -113.62 136.79 48.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.151 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 2.5 mmtt -95.65 119.74 34.69 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.864 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.676 ' CD2' HD21 ' A' ' 79' ' ' LEU . 20.5 m-85 -107.71 136.69 47.03 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.907 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -127.42 132.1 50.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.826 0.346 . . . . 0.0 111.551 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 9.7 t-160 -144.58 123.89 13.03 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.55 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 57.5 35.09 25.46 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.062 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 84.01 -14.19 45.06 Favored Glycine 0 CA--C 1.527 0.815 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.464 -179.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.83 149.26 37.91 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 117.193 0.497 . . . . 0.0 111.198 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -110.44 135.17 51.55 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.058 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -140.8 143.03 34.61 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.739 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.0 mt -118.06 118.13 57.16 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.996 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.4 mp -126.65 127.02 69.8 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.242 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.9 146.44 23.75 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.118 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.508 ' HD1' HD12 ' A' ' 6' ' ' ILE . 53.8 m-85 -135.27 134.66 40.18 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.064 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -81.72 125.77 31.01 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.906 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.2 ptt180 -93.46 153.46 41.37 Favored Pre-proline 0 N--CA 1.464 0.27 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.059 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.1 119.62 6.32 Favored 'Cis proline' 0 C--N 1.351 0.703 0 C-N-CA 123.429 -1.488 . . . . 0.0 112.838 0.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 12.0 p -99.88 130.44 48.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.017 179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -82.6 143.12 31.24 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.779 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -57.1 -36.17 70.31 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.926 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -59.18 -44.76 92.17 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.717 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.72 -40.39 95.25 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 34.9 t -67.8 -49.01 73.34 Favored 'Isoleucine or valine' 0 C--O 1.232 0.139 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.114 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -59.32 -39.79 84.23 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.927 179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -40.71 89.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.823 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.731 ' O ' HG23 ' A' ' 35' ' ' VAL . 0.1 OUTLIER -66.04 -48.21 71.83 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.223 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 44.1 t -59.69 -43.62 91.79 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.245 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 87.6 m -60.66 -38.98 86.66 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.951 179.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.7 m -71.76 -44.45 64.03 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 111.461 0.171 . . . . 0.0 111.461 179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 31' ' ' LYS . 34.5 t -59.52 -50.18 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-O 120.49 0.186 . . . . 0.0 111.444 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.513 ' CE2' HD13 ' A' ' 79' ' ' LEU . 34.1 m-85 -83.71 -26.57 29.67 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 -179.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.24 -11.13 61.84 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 120.926 -0.654 . . . . 0.0 113.145 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.451 ' O ' HD12 ' A' ' 40' ' ' LEU . 1.6 mp0 -141.54 156.96 66.46 Favored Pre-proline 0 N--CA 1.465 0.283 0 CA-C-N 116.978 0.389 . . . . 0.0 110.702 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.401 ' HD2' ' HB3' ' A' ' 38' ' ' GLN . 56.6 Cg_endo -71.16 111.68 3.13 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.586 2.191 . . . . 0.0 112.524 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.451 HD12 ' O ' ' A' ' 38' ' ' GLN . 6.4 mp -101.68 157.92 16.48 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.152 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -99.89 138.05 37.5 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.968 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.601 HD23 HG21 ' A' ' 77' ' ' ILE . 3.7 mp -91.79 112.63 24.63 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.994 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -103.05 111.81 24.34 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.117 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.549 ' HE2' HD12 ' A' ' 75' ' ' LEU . 13.6 t80 -104.35 117.44 34.19 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.591 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 6.4 mtp -123.49 126.53 46.9 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.824 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 -74.0 -59.59 2.65 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.43 179.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -170.22 -54.75 0.02 OUTLIER 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.431 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -104.32 -31.82 9.37 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.498 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 6.5 mp -108.76 144.25 36.83 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.79 0.328 . . . . 0.0 111.329 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.2 m -113.59 123.48 50.07 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.994 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -114.53 133.35 60.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.916 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 10.0 tt -93.65 124.73 37.84 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.982 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.83 HD23 ' HB3' ' A' ' 58' ' ' ASP . 4.2 mt -75.89 94.44 3.35 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.454 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -85.47 -34.31 21.65 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.416 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -160.51 -169.83 2.58 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.776 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -61.2 -29.82 70.04 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.493 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.95 -47.08 68.37 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.795 0.331 . . . . 0.0 110.725 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.83 ' HB3' HD23 ' A' ' 53' ' ' LEU . 1.7 t70 -67.64 -40.47 84.59 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.004 179.441 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.6 tp -66.8 -37.47 84.61 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.277 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.834 ' HA ' HD12 ' A' ' 63' ' ' ILE . 4.5 t70 -61.18 -42.79 99.19 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.12 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.92 -35.64 80.46 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.613 179.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.99 -37.36 86.84 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.055 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.834 HD12 ' HA ' ' A' ' 60' ' ' ASP . 7.9 mt -63.83 -40.76 90.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.956 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -53.31 -45.39 68.96 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.864 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.7 mt -69.04 -36.38 73.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.115 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.941 HD22 HD21 ' A' ' 75' ' ' LEU . 22.1 tp -68.91 -41.98 77.48 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.87 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -62.42 -42.39 99.41 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.218 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 5.2 ptm85 -71.66 -30.46 65.75 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.553 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 78.7 p -88.99 108.95 19.86 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 120.892 0.377 . . . . 0.0 111.052 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 5.2 m -76.07 -34.61 59.57 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.23 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 81.5 p -63.81 -35.0 79.18 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.348 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.8 tpp -84.54 158.67 20.88 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.959 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.3 tttt -145.6 -54.8 0.29 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.084 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . 0.51 ' C ' HD22 ' A' ' 75' ' ' LEU . 78.7 p -93.08 173.9 7.5 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.827 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.941 HD21 HD22 ' A' ' 66' ' ' LEU . 3.8 mm? -122.88 131.04 53.57 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.991 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.427 ' O ' HD13 ' A' ' 77' ' ' ILE . 11.2 mtm180 -86.55 109.21 18.96 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.984 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.601 HG21 HD23 ' A' ' 42' ' ' LEU . 17.4 mm -124.88 132.38 71.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.088 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.632 HD23 HD11 ' A' ' 80' ' ' LEU . 3.5 tp -101.97 131.52 48.33 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.554 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.676 HD21 ' CD2' ' A' ' 8' ' ' PHE . 1.3 mt -102.19 119.68 39.2 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.051 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.632 HD11 HD23 ' A' ' 78' ' ' LEU . 2.2 mp -141.3 145.39 35.44 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.678 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.4 t -63.58 120.37 11.62 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.951 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -152.98 48.21 0.71 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.28 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -148.42 96.07 2.55 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.241 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.54 43.31 2.93 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.215 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 67.3 169.69 0.25 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.279 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 6.2 mp -77.52 -52.34 9.23 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.958 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 53.96 66.91 1.1 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.461 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.3 m80 -90.48 -62.31 1.49 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.014 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 68.0 144.5 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.86 0.362 . . . . 0.0 111.397 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 23.7 t60 -108.09 98.72 8.24 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.155 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -151.97 97.89 2.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.826 179.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -98.21 -42.82 7.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.028 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.756 -179.996 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 120.804 0.335 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.2 t -162.28 157.67 23.19 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.88 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.41 ' HA ' ' HA ' ' A' ' 20' ' ' SER . 8.4 t0 -72.39 108.57 5.56 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.597 179.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.7 t -99.97 127.37 52.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.959 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.92 121.76 29.85 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.891 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.538 HD12 ' CD2' ' A' ' 19' ' ' PHE . 31.1 mt -111.61 130.08 65.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.965 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -103.72 113.3 26.72 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.734 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.674 ' HB3' HD11 ' A' ' 79' ' ' LEU . 64.5 m-85 -97.14 143.95 27.45 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.088 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -135.59 127.55 29.55 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.197 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -147.85 118.14 7.35 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.552 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 58.74 35.31 24.3 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.095 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.01 6.79 89.22 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 120.949 -0.643 . . . . 0.0 113.249 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -100.59 111.09 23.29 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 117.162 0.481 . . . . 0.0 110.792 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.3 ptt85 -94.64 141.66 28.35 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.197 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.4 mtt85 -143.72 141.24 30.39 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.054 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 21.8 mt -112.62 128.0 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.185 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.113 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.7 mp -134.07 137.82 51.38 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.226 179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.8 135.85 33.45 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.073 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.538 ' CD2' HD12 ' A' ' 6' ' ' ILE . 75.0 m-85 -135.67 116.84 14.44 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.148 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' ASP . 0.3 OUTLIER -93.14 135.24 34.51 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.975 179.692 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 10.1 mtt180 -78.55 155.73 78.52 Favored Pre-proline 0 N--CA 1.463 0.193 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.933 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.93 125.56 11.46 Favored 'Cis proline' 0 C--N 1.35 0.64 0 C-N-CA 123.406 -1.498 . . . . 0.0 112.494 -0.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 11.0 p -108.04 128.5 63.37 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.004 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 20.4 mttt -92.83 143.22 26.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.166 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.401 ' HB2' ' HG2' ' A' ' 56' ' ' GLN . 72.4 t80 -56.48 -39.44 73.23 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.833 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -64.73 -39.38 93.54 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.937 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -44.19 96.94 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.935 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.66 ' O ' HG23 ' A' ' 32' ' ' VAL . 21.9 t -68.73 -48.04 73.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.051 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -59.99 -40.04 87.81 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.145 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.48 -39.99 81.49 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.665 179.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.702 ' O ' HG23 ' A' ' 35' ' ' VAL . 14.8 tttt -69.13 -46.56 67.34 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.45 179.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' ' 28' ' ' VAL . 18.0 t -59.76 -48.52 87.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.399 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -60.77 -38.46 85.33 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.491 -179.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 60.8 m -69.83 -45.39 67.93 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 111.682 0.252 . . . . 0.0 111.682 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 31' ' ' LYS . 47.9 t -60.02 -49.27 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-O 120.492 0.186 . . . . 0.0 111.352 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.715 ' CE2' HD13 ' A' ' 79' ' ' LEU . 27.1 m-85 -80.96 -23.6 38.67 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.722 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.2 19.64 76.65 Favored Glycine 0 CA--C 1.523 0.574 0 C-N-CA 120.942 -0.647 . . . . 0.0 112.908 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.485 ' O ' HD12 ' A' ' 40' ' ' LEU . 13.1 mt-30 -155.92 148.36 17.74 Favored Pre-proline 0 C--O 1.233 0.217 0 CA-C-N 116.792 0.296 . . . . 0.0 111.005 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -74.35 104.29 1.83 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.701 2.267 . . . . 0.0 112.325 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.485 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.2 mp -109.23 138.32 45.77 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.059 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -81.22 138.42 35.79 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.064 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.2 mp -90.61 120.66 31.86 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.871 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -108.27 116.76 32.56 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.235 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.535 ' HB2' HD11 ' A' ' 53' ' ' LEU . 17.7 t80 -110.32 120.36 42.17 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.83 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -130.44 135.58 48.14 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.831 179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -77.4 -62.55 1.62 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.863 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -166.85 -53.69 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.366 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -104.5 -32.46 8.97 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.417 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.427 HD13 ' H ' ' A' ' 50' ' ' SER . 0.1 OUTLIER -106.49 137.32 44.69 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.692 0.282 . . . . 0.0 111.236 -179.725 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.427 ' H ' HD13 ' A' ' 49' ' ' LEU . 15.7 m -113.82 130.4 56.47 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.841 179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.4 mt -124.01 133.01 70.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.195 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 8.2 tt -89.68 131.33 35.71 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.821 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.535 HD11 ' HB2' ' A' ' 44' ' ' TYR . 7.3 mt -87.58 103.85 15.95 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.896 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -109.12 -36.55 6.03 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.025 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -128.05 174.48 9.18 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.171 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.401 ' HG2' ' HB2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -62.56 -32.48 73.45 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.074 179.813 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -54.12 -41.54 68.45 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.583 -0.28 . . . . 0.0 111.034 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.518 ' HB3' HD23 ' A' ' 53' ' ' LEU . 7.8 m-20 -63.39 -47.5 81.79 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.012 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.06 -40.16 90.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.89 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.58 ' HA ' HD12 ' A' ' 63' ' ' ILE . 0.9 OUTLIER -62.05 -42.97 99.75 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.731 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.57 -33.39 74.92 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.961 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.44 -37.21 84.98 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.275 179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.58 HD12 ' HA ' ' A' ' 60' ' ' ASP . 8.8 mt -65.77 -43.91 93.26 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.083 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.645 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.16 -45.36 91.21 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.079 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 26.3 mt -68.26 -41.42 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.091 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 4.2 tp -68.74 -39.81 80.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.165 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 77.9 m-20 -62.48 -41.89 99.1 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.653 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.6 ptt180 -67.7 -26.99 66.45 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.622 0.249 . . . . 0.0 110.958 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.1 t -70.34 127.33 32.38 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.716 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 19.1 m -60.82 -37.08 80.77 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.421 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.9 -65.57 0.66 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.196 -179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 9.9 ptt? 37.94 66.36 0.48 Allowed 'General case' 0 N--CA 1.468 0.432 0 O-C-N 123.437 0.46 . . . . 0.0 111.846 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm -110.05 89.32 2.99 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.823 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.6 m 63.32 170.34 0.15 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.637 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.8 mp -110.33 122.69 48.29 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.102 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.63 107.44 19.43 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.648 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 27.9 mt -129.67 131.36 66.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.87 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.1 tp -101.9 126.87 48.89 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.617 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.715 HD13 ' CE2' ' A' ' 36' ' ' PHE . 3.5 mt -93.56 134.38 35.91 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.005 -179.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.2 pp -150.95 144.09 24.72 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.987 179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.2 m -63.02 127.39 31.0 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.124 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -149.18 40.05 0.85 Allowed 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.816 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -106.72 111.44 23.97 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.855 0.36 . . . . 0.0 111.302 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 5.6 mmt180 64.21 94.93 0.05 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.138 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -98.79 125.94 44.29 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.065 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -135.07 -57.94 0.8 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.789 179.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.73 168.83 21.09 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.063 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 14.1 m80 -78.71 125.38 29.3 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.21 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 28.9 m-70 -82.92 174.88 10.52 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.101 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -135.31 94.09 3.07 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.106 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -130.85 115.56 16.74 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.708 179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -105.32 179.74 4.18 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.96 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.049 -0.977 . . . . 0.0 111.39 179.995 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 120.686 0.279 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.4 m -147.08 152.09 37.95 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.262 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 68.81 144.32 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.483 179.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 17.1 t -139.85 123.51 18.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.204 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.2 108.39 19.27 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.571 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.486 HD12 ' CD2' ' A' ' 19' ' ' PHE . 22.8 mt -108.43 125.07 65.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.97 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -95.63 120.36 35.73 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.658 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.661 ' HD2' HD12 ' A' ' 17' ' ' ILE . 61.0 m-85 -113.1 127.41 56.19 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.66 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 14' ' ' ARG . 4.5 pt-20 -123.35 139.86 53.6 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.948 0.404 . . . . 0.0 111.429 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -137.89 114.44 10.41 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.451 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 61.22 38.14 16.89 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.125 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.09 -14.33 59.26 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.332 -179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -88.41 105.98 17.95 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 117.073 0.436 . . . . 0.0 110.783 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.403 ' HA ' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -91.44 156.23 17.87 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.073 -179.958 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.1 157.92 43.77 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.046 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.5 mt -114.64 120.29 63.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.661 HD12 ' HD2' ' A' ' 8' ' ' PHE . 11.7 mt -130.71 126.92 61.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.732 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -90.09 146.51 24.26 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.212 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.486 ' CD2' HD12 ' A' ' 6' ' ' ILE . 29.4 m-85 -138.46 132.84 31.93 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.049 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 p -81.36 165.9 20.93 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.201 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -110.25 143.87 28.95 Favored Pre-proline 0 CA--C 1.529 0.159 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.13 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.52 136.0 41.27 Favored 'Cis proline' 0 C--N 1.35 0.634 0 C-N-CA 123.362 -1.516 . . . . 0.0 112.576 -0.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 13.0 p -88.77 129.43 39.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.031 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.469 ' O ' HG23 ' A' ' 28' ' ' VAL . 71.2 mmtt -100.49 130.71 46.6 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -54.73 -45.26 74.09 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.113 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -58.76 -42.44 88.91 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.049 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -62.88 -44.26 96.57 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.005 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 24' ' ' LYS . 24.5 t -64.69 -48.24 85.48 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.874 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.09 -36.48 81.83 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.014 179.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -58.36 -36.91 74.18 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.13 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.678 ' O ' HG23 ' A' ' 35' ' ' VAL . 3.8 mttt -72.91 -47.92 41.62 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.669 0.271 . . . . 0.0 110.523 179.394 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.73 -45.43 94.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.264 179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.2 t -61.67 -38.62 88.43 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.444 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 27.9 m -71.4 -44.29 65.19 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.678 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.0 t -60.67 -50.26 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -179.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.9 m-85 -83.82 -24.78 30.82 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.53 24.81 32.25 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.913 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.619 ' O ' HD12 ' A' ' 40' ' ' LEU . 14.1 pt20 -177.43 147.58 0.67 Allowed Pre-proline 0 N--CA 1.465 0.296 0 CA-C-N 116.638 0.219 . . . . 0.0 110.611 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.83 108.4 2.56 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.397 2.065 . . . . 0.0 112.0 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.68 HD22 ' CD1' ' A' ' 79' ' ' LEU . 5.1 mp -89.79 140.8 29.24 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.088 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -75.83 120.34 21.05 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.013 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.508 HD23 ' HB3' ' A' ' 79' ' ' LEU . 67.6 mt -86.71 122.9 31.25 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.449 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -112.89 124.4 52.53 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.111 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.441 ' CD2' HD11 ' A' ' 75' ' ' LEU . 11.7 t80 -108.51 129.01 55.3 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.554 179.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 6.1 mtt -117.44 127.02 53.61 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.726 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -86.56 -51.93 5.86 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.719 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -173.54 -63.12 0.02 OUTLIER 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.422 179.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.61 -27.52 11.3 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.489 179.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.13 153.2 26.06 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 120.901 0.381 . . . . 0.0 111.31 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 28.4 t -117.22 128.69 55.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.768 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.8 mm -113.85 133.44 59.81 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.611 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.473 HD23 ' N ' ' A' ' 53' ' ' LEU . 6.8 tt -95.79 130.06 42.83 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.172 -179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.473 ' N ' HD23 ' A' ' 52' ' ' LEU . 1.2 mt -81.95 107.88 15.02 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.987 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.21 -38.65 4.67 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.408 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.6 m-80 -131.67 -179.39 5.35 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.091 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -64.63 -30.19 71.2 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.816 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -57.91 -39.32 77.65 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.583 0.23 . . . . 0.0 110.928 179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -68.46 -43.28 77.34 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.832 0.348 . . . . 0.0 110.488 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.1 tt -62.56 -44.78 95.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.933 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.23 -41.46 98.43 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.7 mtpm? -66.15 -36.74 83.92 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.217 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.9 -41.48 99.44 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.599 0.238 . . . . 0.0 111.522 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 11.8 mt -66.12 -43.25 92.28 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.147 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.587 179.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.9 -42.7 76.41 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.177 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 14.7 mt -66.43 -42.16 89.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.042 179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.625 HD22 HD23 ' A' ' 75' ' ' LEU . 15.8 tp -59.78 -44.58 93.84 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.887 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.54 -35.96 70.99 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.902 179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 21.2 ttt-85 -70.61 -35.12 72.82 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.298 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 29.5 t -86.49 94.19 9.36 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.718 0.294 . . . . 0.0 111.048 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 91.2 p -58.79 -36.98 75.33 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.145 179.543 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.2 p -60.35 -33.68 72.76 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.389 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.0 mtt -85.88 123.7 31.53 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.187 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.91 -33.95 7.78 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.233 179.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 2.0 m -116.65 156.46 27.02 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.583 0.23 . . . . 0.0 110.962 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.625 HD23 HD22 ' A' ' 66' ' ' LEU . 0.2 OUTLIER -91.88 129.35 37.87 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.662 179.817 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.404 ' N ' HD13 ' A' ' 75' ' ' LEU . 0.0 OUTLIER -97.17 107.82 20.42 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.048 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.574 ' CG1' HD12 ' A' ' 75' ' ' LEU . 2.9 mp -128.08 132.16 68.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.956 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 25.7 tp -102.51 118.29 36.54 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.912 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.68 ' CD1' HD22 ' A' ' 40' ' ' LEU . 2.7 pp -110.96 135.41 51.52 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.949 179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.447 ' C ' HD23 ' A' ' 40' ' ' LEU . 1.1 mp -137.54 148.05 45.64 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.162 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 1.7 m -74.98 98.8 3.68 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.696 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -145.19 63.2 1.29 Allowed 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.817 0.341 . . . . 0.0 110.915 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -108.52 120.42 42.39 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.343 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.46 37.1 2.71 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.603 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -132.56 122.31 24.6 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.143 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 3.1 tp -156.79 43.13 0.37 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.91 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -77.63 151.83 34.14 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.124 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -128.68 -54.75 1.23 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.083 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -97.93 30.19 3.14 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.072 179.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -142.36 113.03 7.33 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.898 179.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -177.07 -42.4 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.254 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 56.0 t60 76.34 134.83 0.06 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.241 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 15.2 t60 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.42 -0.8 . . . . 0.0 110.891 -179.979 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 120.599 0.238 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.19 169.38 0.22 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.28 -179.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 54.71 85.11 0.06 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.273 -179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.1 t -87.48 127.81 40.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.245 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -98.54 106.87 19.2 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.685 179.54 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.531 ' CG2' HD12 ' A' ' 77' ' ' ILE . 4.0 mp -109.19 133.77 53.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.307 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.82 105.13 13.86 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.546 179.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.747 ' HB3' HD11 ' A' ' 79' ' ' LEU . 45.6 m-85 -93.17 148.52 21.95 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.15 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -135.7 125.08 24.84 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.982 0.42 . . . . 0.0 111.153 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.2 t-160 -142.16 129.45 21.1 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.514 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 60.45 29.44 19.01 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.29 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 86.79 -14.1 57.17 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 120.875 -0.679 . . . . 0.0 113.304 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 72.8 mt-10 -91.67 132.04 36.64 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 117.078 0.439 . . . . 0.0 110.903 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -101.9 147.7 26.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.184 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 5.6 ttt85 -137.1 141.28 42.33 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.969 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.8 mt -111.72 120.76 62.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.125 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 33.5 mt -133.3 132.74 58.2 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.141 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -101.31 141.65 33.88 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.164 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -123.77 134.94 53.57 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.342 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.6 m -87.47 134.85 33.54 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.142 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.51 149.23 74.81 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.968 179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.22 121.99 8.28 Favored 'Cis proline' 0 C--N 1.35 0.651 0 C-N-CA 123.312 -1.537 . . . . 0.0 112.5 -0.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.421 HG13 ' O ' ' A' ' 23' ' ' VAL . 14.0 p -83.04 119.63 32.88 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.785 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.434 ' O ' HG23 ' A' ' 28' ' ' VAL . 7.0 mmmt -98.74 143.79 28.7 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.946 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -54.63 -41.41 69.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.001 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.84 -44.48 96.9 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.76 179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -62.63 -44.2 96.88 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.259 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 24' ' ' LYS . 22.5 t -67.25 -48.4 78.35 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.105 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -58.04 -39.05 77.45 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.811 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -58.92 -45.8 89.49 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.836 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.678 ' O ' HG23 ' A' ' 35' ' ' VAL . 3.7 mmtt -61.11 -47.88 84.26 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.946 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.2 t -59.0 -46.83 91.42 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-O 120.725 0.298 . . . . 0.0 110.849 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.513 HG23 ' N ' ' A' ' 39' ' ' PRO . 22.5 m -61.54 -40.16 93.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.287 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 58.9 m -71.73 -46.22 59.28 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.678 HG23 ' O ' ' A' ' 31' ' ' LYS . 48.1 t -62.79 -50.1 81.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 121.224 -0.19 . . . . 0.0 111.495 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.545 ' CZ ' HD13 ' A' ' 79' ' ' LEU . 85.6 m-85 -83.86 -19.39 34.94 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.306 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 95.88 -20.42 49.95 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 120.522 -0.847 . . . . 0.0 112.958 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.501 ' O ' HD12 ' A' ' 40' ' ' LEU . 18.0 mt-30 -134.81 147.36 62.65 Favored Pre-proline 0 N--CA 1.462 0.141 0 CA-C-N 116.816 0.308 . . . . 0.0 110.387 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.513 ' N ' HG23 ' A' ' 33' ' ' THR . 57.6 Cg_endo -72.79 99.25 1.05 Allowed 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.395 2.063 . . . . 0.0 112.269 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.501 HD12 ' O ' ' A' ' 38' ' ' GLN . 3.2 mp -87.82 156.8 19.22 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.026 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -91.12 140.28 29.97 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.975 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.64 107.47 19.23 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.99 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -106.23 113.9 27.7 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.994 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.414 ' CD2' HG12 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -91.68 129.15 37.7 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.219 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 2.4 ppp? -125.35 118.23 25.46 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.951 0.405 . . . . 0.0 110.707 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -88.86 -71.47 0.59 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.049 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -136.19 -72.11 0.45 Allowed 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.37 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -120.9 19.44 11.72 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.127 179.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.72 147.46 52.51 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.766 0.317 . . . . 0.0 111.134 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 26.0 p -119.17 126.66 52.09 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.58 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mp -113.62 131.53 65.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.626 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -107.29 121.36 44.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.255 -179.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 51.6 mt -77.3 95.53 4.38 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.565 179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.08 -34.85 11.57 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.134 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -138.24 173.18 11.89 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.847 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -59.26 -34.71 72.57 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.219 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -53.88 -41.14 67.22 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.916 0.389 . . . . 0.0 110.736 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.99 -39.77 94.87 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.011 179.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 7.7 tp -65.35 -43.27 91.39 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.886 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.85 -41.55 97.97 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.797 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 5.3 ttmt -65.21 -36.73 85.1 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.957 179.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -62.47 -39.17 92.55 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.499 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 25.4 mt -64.23 -43.18 97.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.751 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.43 -39.27 70.05 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.187 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.8 mt -67.32 -44.62 87.16 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.133 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.572 HD13 ' HG ' ' A' ' 75' ' ' LEU . 1.0 OUTLIER -59.63 -47.24 86.38 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.537 -0.302 . . . . 0.0 110.683 179.933 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -64.26 -37.39 87.31 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.894 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.7 -33.03 74.95 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.2 179.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.1 t -67.02 136.24 54.97 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.83 0.348 . . . . 0.0 111.252 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 18.2 m -74.77 -25.75 59.28 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.501 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.1 t -134.4 82.35 1.96 Allowed 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 121.06 0.457 . . . . 0.0 110.578 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 30.7 tpp -158.25 105.44 1.91 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.596 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -102.82 -63.15 1.19 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.028 -179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.8 t -82.0 158.17 23.94 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.181 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.572 ' HG ' HD13 ' A' ' 66' ' ' LEU . 7.2 mp -101.15 125.22 47.76 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.102 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.28 107.38 19.03 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.662 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.531 HD12 ' CG2' ' A' ' 6' ' ' ILE . 22.1 mt -129.44 131.77 67.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.829 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.82 132.32 47.65 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.636 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.747 HD11 ' HB3' ' A' ' 8' ' ' PHE . 10.0 mt -93.66 128.81 40.02 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.174 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.9 mt -133.96 136.24 44.04 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -70.48 103.08 2.36 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.767 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -123.68 46.08 2.31 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.121 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -98.08 116.05 29.5 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.772 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.52 32.26 2.54 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.483 179.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -163.44 179.26 7.43 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.679 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.6 mp -115.25 -63.94 1.39 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.927 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -117.83 -46.79 2.63 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.803 179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -148.57 138.74 22.43 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.151 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -163.2 -60.97 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.043 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 38.0 t60 -122.45 -61.32 1.48 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.81 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 16.0 p-80 -91.86 143.32 26.63 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.017 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -166.67 87.58 0.32 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.95 0.405 . . . . 0.0 111.379 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 118.488 -0.768 . . . . 0.0 110.656 179.665 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.819 0.343 . . . . 0.0 111.269 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.7 p -147.33 177.48 9.18 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.192 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 66.46 102.13 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.419 0.449 . . . . 0.0 110.974 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.8 t -97.78 135.96 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.328 -179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.0 114.37 23.55 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.113 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.53 ' CG2' HD12 ' A' ' 77' ' ' ILE . 31.0 mm -109.06 119.75 59.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.901 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.41 114.46 26.23 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.746 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . 0.473 ' CD2' HD12 ' A' ' 17' ' ' ILE . 51.8 m-85 -100.37 140.32 34.79 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.184 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.72 124.74 20.03 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.124 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -138.89 112.04 7.99 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.575 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 58.46 36.3 25.24 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.353 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.69 -14.27 61.98 Favored Glycine 0 CA--C 1.526 0.726 0 C-N-CA 120.886 -0.674 . . . . 0.0 113.096 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.8 104.55 11.39 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.957 0.379 . . . . 0.0 110.622 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptp85 -92.3 136.85 32.86 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.189 -179.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.434 ' HD3' HD11 ' A' ' 17' ' ' ILE . 16.0 ttt85 -137.06 143.53 42.68 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.162 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.2 mt -109.93 120.71 61.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.864 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.473 HD12 ' CD2' ' A' ' 8' ' ' PHE . 27.8 mt -134.72 132.55 54.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.168 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.59 143.83 25.94 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.128 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.506 ' CE2' HG22 ' A' ' 28' ' ' VAL . 6.9 m-85 -129.99 121.14 25.94 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.282 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -76.11 129.41 36.76 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.838 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -70.25 150.73 95.94 Favored Pre-proline 0 N--CA 1.463 0.212 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.086 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -75.24 134.13 34.52 Favored 'Cis proline' 0 C--N 1.35 0.651 0 C-N-CA 123.705 -1.373 . . . . 0.0 112.472 0.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 23' ' ' VAL . 11.6 p -84.12 118.32 31.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 CA-C-O 120.944 0.402 . . . . 0.0 110.792 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.48 ' O ' HG23 ' A' ' 28' ' ' VAL . 20.3 mmtm -101.1 129.94 47.07 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.862 -179.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.631 ' CE1' HD12 ' A' ' 42' ' ' LEU . 54.0 t80 -55.55 -45.16 77.28 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.952 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -60.1 -42.32 94.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.053 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -62.49 -44.07 97.27 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.036 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.562 ' O ' HG23 ' A' ' 32' ' ' VAL . 23.3 t -66.75 -48.0 81.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.577 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.8 -41.59 87.12 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.207 179.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -57.31 -45.36 84.28 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.877 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.74 ' O ' HG23 ' A' ' 35' ' ' VAL . 3.4 tttm -66.54 -47.83 71.65 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.691 -0.232 . . . . 0.0 110.989 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 28' ' ' VAL . 45.8 t -58.34 -43.67 86.77 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.711 0.291 . . . . 0.0 110.982 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 97.2 m -62.84 -38.92 92.7 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.905 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.6 m -71.68 -45.61 61.39 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.384 179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.74 HG23 ' O ' ' A' ' 31' ' ' LYS . 40.9 t -58.88 -49.69 82.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 120.524 0.202 . . . . 0.0 111.509 -179.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -83.4 -26.91 29.99 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.76 25.54 32.1 Favored Glycine 0 CA--C 1.524 0.649 0 C-N-CA 120.963 -0.637 . . . . 0.0 112.954 -179.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.556 ' O ' HD12 ' A' ' 40' ' ' LEU . 0.1 OUTLIER -169.97 145.67 2.48 Favored Pre-proline 0 N--CA 1.464 0.265 0 CA-C-N 116.871 0.335 . . . . 0.0 110.96 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -72.52 103.52 1.56 Allowed 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 122.586 2.191 . . . . 0.0 112.394 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.556 HD12 ' O ' ' A' ' 38' ' ' GLN . 2.9 mp -96.26 154.92 16.99 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.107 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -88.72 140.97 28.9 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.997 179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.631 HD12 ' CE1' ' A' ' 25' ' ' TYR . 67.5 mt -100.71 124.05 45.78 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.606 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.486 ' ND1' HD21 ' A' ' 80' ' ' LEU . 6.3 m80 -117.0 129.32 55.95 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.162 -179.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.404 ' CD2' ' HB1' ' A' ' 62' ' ' ALA . 19.2 t80 -114.32 129.69 56.65 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.763 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 3.4 mtm -111.31 113.36 25.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.542 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.9 p-10 -67.17 -52.59 39.46 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.282 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.3 m120 -148.84 -73.9 0.18 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.331 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -119.67 14.13 12.58 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.336 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -131.48 148.72 52.66 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.66 0.267 . . . . 0.0 111.164 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.4 m -112.21 128.76 56.34 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.112 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.7 mp -115.96 132.1 66.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.925 179.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.9 tt -81.88 134.31 35.39 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.706 179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp -102.65 104.03 14.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.059 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.43 -35.92 6.37 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.358 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -120.17 170.83 8.95 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.771 0.319 . . . . 0.0 111.051 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.48 -35.51 77.87 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.03 179.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -55.07 -41.16 71.16 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.069 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -64.03 -47.25 80.97 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.68 179.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.487 HD13 ' HD1' ' A' ' 25' ' ' TYR . 5.0 tp -63.17 -41.88 99.3 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.149 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -62.95 -43.07 99.81 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.01 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -34.07 77.23 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.132 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.404 ' HB1' ' CD2' ' A' ' 44' ' ' TYR . . . -62.57 -35.34 79.19 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.275 179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.598 ' CD1' HD11 ' A' ' 75' ' ' LEU . 29.8 mm -64.24 -44.56 97.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.627 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.36 -40.88 71.82 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.118 179.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 37.1 mm -63.34 -45.14 98.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.912 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 tp -62.8 -44.66 95.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.719 179.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -64.32 -34.7 78.75 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.274 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -32.13 71.73 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.054 179.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.8 t -70.9 154.15 42.07 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.047 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.3 p -76.22 -33.66 59.23 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.362 179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.7 p -70.66 -76.01 0.11 Allowed 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.525 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 4.2 ttt 53.33 82.8 0.07 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.849 0.357 . . . . 0.0 111.217 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.85 -39.69 3.24 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.94 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 15.3 t -155.76 162.67 40.47 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.533 0.206 . . . . 0.0 110.946 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.598 HD11 ' CD1' ' A' ' 63' ' ' ILE . 0.3 OUTLIER -94.43 128.22 40.84 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.088 179.938 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.84 109.6 20.93 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.97 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.53 HD12 ' CG2' ' A' ' 6' ' ' ILE . 32.7 mt -128.79 128.64 67.84 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.925 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.99 131.3 48.49 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.741 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.425 HD23 ' CD2' ' A' ' 42' ' ' LEU . 2.3 mt -100.56 133.05 45.58 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.039 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.486 HD21 ' ND1' ' A' ' 43' ' ' HIS . 0.5 OUTLIER -156.57 135.71 12.01 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.83 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.06 101.46 1.14 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.88 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -155.74 65.63 0.6 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.649 -179.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -163.78 81.69 0.44 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.997 0.427 . . . . 0.0 111.076 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.75 -41.93 3.02 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.174 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -147.09 178.5 8.32 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.106 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -104.23 161.98 13.58 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 120.751 0.31 . . . . 0.0 111.275 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -77.71 162.93 26.61 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.282 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -98.75 175.81 5.84 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.36 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.445 ' O ' ' HB2' ' A' ' 90' ' ' HIS . 22.2 m-70 -96.46 172.56 7.86 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.195 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.445 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 2.4 m-70 69.41 103.47 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.284 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -67.67 173.42 4.27 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.024 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 64.98 33.81 9.45 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.736 -179.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.087 -0.959 . . . . 0.0 111.262 179.922 . . . . . . . . 1 1 . 1 stop_ save_