data_2l8n_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 2l8n _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.161 0 CA-C-O 120.781 0.324 . . . . 0.0 110.471 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.8 m -143.55 148.69 36.33 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.361 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 10.5 ptt? -53.62 -27.26 26.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.708 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.4 ttmt -72.54 -41.88 65.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.662 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -63.07 -34.74 78.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.479 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 54.3 t -64.59 -37.44 80.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.589 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.55 -46.18 66.69 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.007 0.432 . . . . 0.0 110.006 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.4 mt -66.98 -39.35 87.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.306 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -65.02 -32.47 74.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.983 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.39 12.7 31.28 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.76 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt 35.46 47.9 0.38 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.319 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.429 ' O ' ' OG ' ' A' ' 22' ' ' SER . 11.4 t -69.03 -79.99 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.814 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.438 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.6 m 167.09 129.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.267 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.2 t -51.55 -29.7 17.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.972 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.55 -41.23 27.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.864 0.364 . . . . 0.0 111.227 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.438 ' OG1' ' O ' ' A' ' 22' ' ' SER . 15.8 p -57.68 -64.88 0.75 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.85 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.4 p -50.87 -34.68 13.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.721 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.9 t -76.63 -32.52 58.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.78 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 31' ' ' MET . 52.4 mmt-85 -82.45 -19.54 38.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.131 0.491 . . . . 0.0 110.103 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.79 -20.04 0.44 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.005 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 pp -102.61 -16.04 16.19 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.718 0.294 . . . . 0.0 110.484 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.409 ' N ' ' O ' ' A' ' 28' ' ' ARG . 41.6 mtt -100.28 -53.5 3.1 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.476 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -143.97 83.37 10.37 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.347 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -80.93 63.06 8.74 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.278 1.986 . . . . 0.0 112.039 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -154.85 34.69 0.4 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.433 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -124.32 -14.73 6.89 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.31 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 97.2 t -65.88 144.56 14.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.066 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.519 ' O ' ' N ' ' A' ' 41' ' ' ARG . 5.6 t -59.6 144.9 46.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.163 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -47.7 -53.85 13.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.637 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.06 -53.15 61.15 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.364 -0.534 . . . . 0.0 109.812 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 86.5 m -62.18 -24.7 67.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.836 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' A' ' 37' ' ' SER . 41.6 ttp180 -70.57 -42.84 70.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.673 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.0 t-20 -65.61 -33.67 76.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.729 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -68.71 -43.38 76.12 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.947 0.403 . . . . 0.0 110.254 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 47.4 t -58.37 -50.55 78.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.155 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -50.61 -50.08 54.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.613 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -70.24 -39.56 74.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.779 0.324 . . . . 0.0 110.672 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.7 -23.54 66.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.736 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.472 ' O ' ' N ' ' A' ' 52' ' ' GLY . . . -73.02 -38.35 66.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.782 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -68.27 -38.0 81.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.927 0.394 . . . . 0.0 110.362 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -59.4 -51.02 71.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.217 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 72.1 t -82.53 -24.45 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.698 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.472 ' N ' ' O ' ' A' ' 48' ' ' ALA . . . . . . . . 0 CA--C 1.527 0.835 0 N-CA-C 112.132 -0.387 . . . . 0.0 112.132 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.196 0 CA-C-O 120.862 0.363 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.4 m -143.66 148.96 36.55 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.226 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 11.5 tpt -48.26 -30.0 4.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.691 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -74.55 -42.01 59.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.693 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -62.0 -34.51 76.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.87 0.367 . . . . 0.0 110.588 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.5 t -62.03 -40.51 87.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.259 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.494 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.86 -41.77 64.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.409 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.6 tp -59.95 -42.86 94.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.322 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -63.89 -33.32 75.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.769 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.65 5.68 36.57 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.753 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 16' ' ' ALA . 65.9 mttm 41.41 46.98 3.04 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.078 0.466 . . . . 0.0 110.641 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 80.0 t -70.07 -81.87 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.137 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.431 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.5 t 171.36 129.74 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.335 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 35.6 m -62.92 -28.61 70.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.728 -179.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.42 ' O ' ' OG ' ' A' ' 27' ' ' SER . . . -79.65 -38.85 32.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.918 0.39 . . . . 0.0 111.253 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' A' ' 22' ' ' SER . 17.9 p -56.63 -64.48 0.86 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.838 -178.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.9 t -51.54 -25.52 5.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.481 ' HG ' ' N ' ' A' ' 28' ' ' ARG . 4.2 p -77.15 -31.49 55.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.377 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' A' ' 32' ' ' ASN . 97.4 mtt180 -82.07 -19.48 40.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.217 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.46 -19.92 0.99 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.108 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.436 ' CD1' ' N ' ' A' ' 30' ' ' LEU . 9.7 mp -97.12 -12.28 23.32 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.564 0.221 . . . . 0.0 110.924 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 20.2 mmt -121.62 -52.08 2.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.803 0.335 . . . . 0.0 110.894 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 28' ' ' ARG . 9.6 t-20 -130.22 80.6 70.38 Favored Pre-proline 0 N--CA 1.466 0.339 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.382 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.99 61.61 7.88 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 C-N-CA 122.475 2.117 . . . . 0.0 112.298 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -161.68 44.53 0.16 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.622 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -127.18 -20.69 4.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.632 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.1 t -66.59 141.93 17.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.536 ' O ' ' N ' ' A' ' 41' ' ' ARG . 1.6 m -58.43 143.3 45.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.791 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -47.48 -53.87 13.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.739 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.49 -52.26 66.4 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.805 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.5 m -64.68 -22.01 66.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.887 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.536 ' N ' ' O ' ' A' ' 37' ' ' SER . 16.9 tpt180 -71.01 -42.21 69.88 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.614 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.517 HD21 ' N ' ' A' ' 42' ' ' ASN . 1.2 m-80 -68.76 -36.32 78.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.864 0.364 . . . . 0.0 110.765 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 45.3 ttm-85 -68.11 -44.14 76.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.107 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.511 ' O ' ' N ' ' A' ' 48' ' ' ALA . 37.2 t -58.88 -48.89 84.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.911 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.6 tt0 -50.11 -50.82 47.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.61 -179.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -70.3 -35.53 73.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.85 0.357 . . . . 0.0 110.576 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.81 -23.61 60.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.409 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -68.01 -39.2 83.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.61 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -71.87 -34.51 69.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.331 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -53.84 -50.71 65.61 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.546 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 p -79.43 -8.24 11.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.535 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.758 0 N-CA-C 111.647 -0.581 . . . . 0.0 111.647 179.109 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.169 0 CA-C-O 120.714 0.292 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.0 m -146.33 149.56 34.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.367 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 63.3 mtt -50.89 -25.27 4.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.481 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -75.57 -43.25 49.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.951 -179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -62.35 -33.95 75.7 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.636 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 77.8 t -65.15 -37.39 80.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.591 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.36 -45.2 65.65 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.7 tp -54.09 -41.5 68.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.32 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -69.9 -42.83 72.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.028 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.61 -0.38 37.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.153 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp 42.91 33.43 0.5 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.974 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -74.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.131 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 2.0 t 172.35 139.37 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.352 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.8 m -67.66 -28.87 68.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.045 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.415 ' O ' ' OG ' ' A' ' 27' ' ' SER . . . -78.08 -38.31 44.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.977 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.0 p -57.62 -64.85 0.76 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.129 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.3 p -50.81 -27.67 5.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.191 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 24' ' ' ALA . 60.3 p -82.75 -34.78 27.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.047 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.0 mtt-85 -81.81 -30.48 32.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.853 0.358 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.519 ' C ' ' H ' ' A' ' 31' ' ' MET . . . -53.97 -54.91 32.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.615 -179.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.7 mt -49.77 -10.25 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.843 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.519 ' H ' ' C ' ' A' ' 29' ' ' ALA . 15.6 mmt -115.33 -36.16 4.41 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.857 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' A' ' 34' ' ' ASP . 25.6 m120 -156.01 81.94 3.68 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.822 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -63.33 54.62 0.16 Allowed 'Trans proline' 0 N--CA 1.501 1.928 0 C-N-CA 122.97 2.447 . . . . 0.0 112.451 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' ASN . 19.6 t70 -122.94 -29.56 3.92 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.979 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -66.6 -23.55 66.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.755 0.312 . . . . 0.0 110.735 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.0 m -69.03 139.57 20.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.413 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.522 ' O ' ' N ' ' A' ' 41' ' ' ARG . 58.6 m -71.72 159.31 34.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.228 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -47.06 -58.61 3.83 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.224 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.83 -52.89 63.31 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.099 -0.64 . . . . 0.0 109.452 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 53.4 m -58.52 -25.64 62.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.711 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 37' ' ' SER . 20.1 ttm180 -70.47 -39.32 74.31 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.874 0.369 . . . . 0.0 110.4 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -71.49 -45.55 62.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.942 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.6 ttm180 -63.43 -43.33 97.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.951 0.405 . . . . 0.0 110.067 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.1 t -60.18 -51.83 68.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.851 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -51.0 -44.76 60.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.849 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 55.5 mttm -70.07 -38.26 75.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.669 0.271 . . . . 0.0 110.713 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.42 -22.61 44.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.75 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.09 -44.74 79.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.834 0.35 . . . . 0.0 110.468 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -76.44 -43.6 39.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.964 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 60.1 tt0 -59.57 -42.71 93.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.702 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.3 p -75.6 -22.83 16.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.964 -179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.668 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.948 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.288 0 CA-C-O 120.872 0.368 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.3 p -57.79 155.52 10.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.365 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 70.4 mtp -48.86 -24.69 1.54 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.203 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.45 ' NZ ' ' CB ' ' A' ' 13' ' ' LYS . 8.5 mtmp? -72.44 -42.97 64.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.461 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -57.61 -38.37 74.82 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.821 0.343 . . . . 0.0 110.394 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.53 -47.05 89.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.408 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.58 -29.92 28.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.405 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.82 -48.08 75.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.055 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -71.3 -37.77 71.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.08 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.84 -1.8 58.27 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.864 0.364 . . . . 0.0 110.434 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.46 ' N ' ' O ' ' A' ' 16' ' ' ALA . 40.7 mtmt 43.32 47.25 5.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.705 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' A' ' 22' ' ' SER . 30.2 t -70.05 -79.54 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.662 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.442 ' OG ' ' CG2' ' A' ' 25' ' ' THR . 1.0 OUTLIER 165.78 134.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.111 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.6 m -60.88 -27.87 68.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.425 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.71 -40.93 39.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.836 0.35 . . . . 0.0 111.073 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.442 ' CG2' ' OG ' ' A' ' 22' ' ' SER . 12.3 p -58.33 -65.53 0.64 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.926 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.42 ' H ' ' HG1' ' A' ' 25' ' ' THR . 4.9 p -53.73 -33.91 23.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.997 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.8 t -75.02 -37.1 61.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.682 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.3 mmt85 -82.46 -20.43 36.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.287 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -70.96 -20.5 62.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.896 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.7 mt -61.61 -25.58 67.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.72 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 67.3 mtm -122.35 -14.59 7.84 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.852 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -151.69 82.23 5.65 Favored Pre-proline 0 N--CA 1.464 0.25 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.638 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -79.9 73.92 5.79 Favored 'Trans proline' 0 N--CA 1.492 1.427 0 C-N-CA 122.203 1.935 . . . . 0.0 112.123 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -160.6 28.99 0.16 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.52 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -106.6 -23.19 12.53 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.422 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.6 m -65.75 145.59 13.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.943 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.568 ' O ' ' N ' ' A' ' 41' ' ' ARG . 16.1 t -64.22 153.66 37.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.141 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.504 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 3.1 mp0 -46.81 -56.43 6.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.851 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.39 -51.9 67.92 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 119.944 -0.703 . . . . 0.0 109.654 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 97.2 m -63.06 -21.81 66.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.248 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.568 ' N ' ' O ' ' A' ' 37' ' ' SER . 32.9 ttp180 -71.45 -37.38 71.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.906 0.384 . . . . 0.0 110.967 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -74.56 -39.18 62.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.063 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -64.34 -48.1 76.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.024 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -62.2 -45.13 99.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.042 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -51.04 -50.64 58.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.88 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.1 mmtp -71.62 -33.77 69.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.851 0.358 . . . . 0.0 111.108 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.32 -21.81 61.27 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.074 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.15 -37.86 72.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.803 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -72.65 -38.72 67.58 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.432 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -54.72 -45.78 74.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.742 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.3 m -75.78 -0.8 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.646 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.717 0 N-CA-C 111.174 -0.771 . . . . 0.0 111.174 179.909 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.422 0 CA-C-O 120.738 0.304 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.3 p -61.01 168.81 2.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.398 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.3 ttt -57.09 -24.81 56.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.279 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -68.4 -40.33 81.33 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.193 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -63.3 -36.98 85.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.49 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 92.9 t -58.27 -45.18 89.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.748 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.73 -40.24 62.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.989 0.423 . . . . 0.0 110.401 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.2 tp -56.55 -45.76 81.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.8 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -69.01 -33.94 74.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.293 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.14 -1.39 57.75 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.696 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 46.12 45.61 12.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.977 0.417 . . . . 0.0 110.64 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.41 ' O ' ' CB ' ' A' ' 22' ' ' SER . 21.6 t -69.61 -78.11 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.089 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.438 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.5 t 165.92 136.79 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.422 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.0 m -61.75 -28.07 69.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.067 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.86 -39.84 42.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.819 0.342 . . . . 0.0 111.067 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.438 ' OG1' ' O ' ' A' ' 22' ' ' SER . 19.9 p -57.66 -65.13 0.68 Allowed 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.791 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.9 p -52.3 -31.4 14.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.784 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.5 t -76.2 -36.13 58.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.724 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -79.36 -19.46 50.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.019 0.438 . . . . 0.0 110.276 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.01 -20.04 61.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.693 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 23.7 mt -63.25 -22.31 66.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.403 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 8.3 ptp -121.59 -13.1 8.42 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.581 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -152.24 68.6 7.28 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.505 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.66 161.56 19.12 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.895 2.396 . . . . 0.0 112.337 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 78.38 25.38 0.58 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.473 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -127.07 17.66 7.2 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.319 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 17.4 m -77.02 162.63 4.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.466 ' O ' ' N ' ' A' ' 41' ' ' ARG . 40.9 t -46.13 146.46 1.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.903 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.428 ' CG ' ' N ' ' A' ' 39' ' ' ALA . 14.7 pt20 -47.49 -44.95 25.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.604 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.428 ' N ' ' CG ' ' A' ' 38' ' ' GLN . . . -63.02 -52.93 60.98 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.446 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 85.2 m -64.44 -22.55 66.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.618 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.466 ' N ' ' O ' ' A' ' 37' ' ' SER . 33.5 ttt85 -70.05 -44.9 68.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.032 0.444 . . . . 0.0 110.183 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -74.54 -43.67 54.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.875 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 63.1 mtp180 -65.8 -43.56 88.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.607 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.3 p -65.05 -41.24 91.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 119.842 -0.743 . . . . 0.0 110.327 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -51.26 -50.69 58.73 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.558 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -71.58 -35.48 70.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.838 0.352 . . . . 0.0 111.068 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.18 -21.21 65.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.21 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.03 -47.35 59.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.869 0.366 . . . . 0.0 110.494 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -74.0 -41.7 61.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.922 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -60.61 -50.51 73.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.851 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 45.4 t -76.41 -6.45 8.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.026 0.441 . . . . 0.0 110.334 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.741 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.625 179.186 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.197 0 CA-C-O 120.797 0.332 . . . . 0.0 110.528 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 p -143.58 146.96 33.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.971 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.1 ptm -47.95 -26.25 1.67 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.917 0.389 . . . . 0.0 110.417 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -78.66 -47.26 17.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.568 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -57.61 -36.69 72.12 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 120.872 0.367 . . . . 0.0 110.555 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.6 t -58.42 -45.13 89.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.592 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.73 -41.2 63.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.753 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.7 mt -76.06 -45.27 35.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.588 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.55 -42.97 84.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.876 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.96 16.65 24.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.672 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.9 pttm 35.88 47.74 0.44 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.104 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.401 ' O ' ' CB ' ' A' ' 22' ' ' SER . 17.2 t -68.67 -78.01 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.593 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.401 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.4 t 168.58 138.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.496 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 26.1 m -68.29 -28.04 66.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.818 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.9 -43.8 24.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.837 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.441 ' O ' ' N ' ' A' ' 29' ' ' ALA . 53.0 p -58.21 -65.04 0.71 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.144 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p -50.95 -29.37 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.069 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.6 m -82.08 -36.94 27.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.751 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -82.78 -19.58 37.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.282 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.441 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -48.87 -53.63 18.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.597 -179.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.02 -10.02 57.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.073 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 41.1 mtp -94.17 -52.09 4.53 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.041 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -160.83 86.9 1.76 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.753 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -47.7 107.09 0.12 Allowed 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.404 2.069 . . . . 0.0 111.894 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.539 ' C ' ' H ' ' A' ' 36' ' ' VAL . 29.4 t70 -176.74 -31.22 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.569 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.2 mmmm -66.12 11.37 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.51 -178.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.539 ' H ' ' C ' ' A' ' 34' ' ' ASP . 3.5 m -107.38 127.93 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.541 ' O ' ' N ' ' A' ' 41' ' ' ARG . 39.6 t -72.42 164.59 26.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.534 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -47.6 -54.92 10.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.329 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.33 -53.35 59.27 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.575 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 52.0 m -62.2 -23.26 66.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.045 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -71.26 -44.78 64.6 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.296 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -70.02 -42.68 72.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.12 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 71.3 mtp85 -65.36 -45.36 84.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 110.252 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 28.0 t -60.15 -48.13 89.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.054 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -51.14 -51.67 51.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.739 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -70.23 -39.94 74.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.798 0.333 . . . . 0.0 110.87 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.95 -23.05 61.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.889 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.58 -39.36 64.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.6 ttp180 -69.85 -35.26 74.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.027 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -55.88 -49.86 72.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.47 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.9 p -75.42 -7.16 9.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.782 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.526 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 179.375 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.739 0.304 . . . . 0.0 110.431 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.0 p -140.65 145.45 36.61 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.159 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 22.4 ttt -59.87 -25.17 64.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.633 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -71.78 -46.73 57.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.208 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -61.93 -33.02 73.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.423 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 52.4 t -61.47 -45.98 97.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.612 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.54 -37.47 57.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.528 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.94 -46.35 88.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.022 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -66.54 -33.96 76.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.038 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.64 5.9 50.08 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.381 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.5 ttmt 41.2 45.35 2.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.993 0.425 . . . . 0.0 110.669 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.436 ' O ' ' CB ' ' A' ' 22' ' ' SER . 21.2 t -69.46 -78.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.795 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.6 m 165.87 136.69 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.139 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.6 p -64.65 -28.44 69.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.0 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.03 -40.99 29.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.058 0.456 . . . . 0.0 110.706 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.585 ' HG1' ' H ' ' A' ' 26' ' ' VAL . 18.6 p -57.15 -64.25 0.94 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.165 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.585 ' H ' ' HG1' ' A' ' 25' ' ' THR . 5.7 p -50.15 -27.02 3.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.825 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.7 m -80.13 -32.06 38.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -82.09 -19.37 40.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.179 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.17 -19.47 64.0 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.58 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.2 mt -86.63 -15.63 39.13 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.204 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.1 mmt -100.31 -32.2 10.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.416 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.443 ' CB ' ' HZ3' ' A' ' 35' ' ' LYS . 25.6 m120 -160.18 147.42 12.5 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.435 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.53 -45.12 0.13 Allowed 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.257 1.971 . . . . 0.0 112.253 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -69.65 55.41 0.12 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.42 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HZ3' ' CB ' ' A' ' 32' ' ' ASN . 39.5 mmtm -127.41 -5.8 5.92 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.902 0.382 . . . . 0.0 110.303 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.1 m -104.52 142.79 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.282 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.525 ' O ' ' N ' ' A' ' 41' ' ' ARG . 39.6 m -66.01 160.01 24.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.168 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.559 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -47.42 -48.49 26.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.41 -179.427 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.43 -53.16 56.64 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.221 -0.592 . . . . 0.0 109.643 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.7 m -62.3 -22.88 66.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.774 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.525 ' N ' ' O ' ' A' ' 37' ' ' SER . 56.9 ttt180 -71.46 -44.2 65.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.613 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -72.32 -42.78 65.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.465 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -65.12 -45.06 86.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.836 0.351 . . . . 0.0 110.591 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 25.4 t -60.79 -45.57 97.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.987 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -50.95 -52.52 41.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.68 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -71.69 -38.07 70.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.726 0.298 . . . . 0.0 111.071 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.61 -22.21 61.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.92 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.15 -42.8 62.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.422 ' CA ' ' HE ' ' A' ' 49' ' ' ARG . 0.0 OUTLIER -64.74 -34.78 79.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.313 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -53.49 -50.45 65.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.189 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.4 t -90.95 -3.35 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.111 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.775 0 N-CA-C 111.624 -0.59 . . . . 0.0 111.624 179.451 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.157 0 CA-C-O 120.793 0.33 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.5 p -140.83 146.41 37.54 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.175 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.2 mtm -56.9 -24.86 55.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.6 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 53.2 mttm -71.88 -41.62 67.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.889 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -66.28 -37.51 85.61 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.046 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 74.9 t -67.25 -32.63 58.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.476 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.59 -46.53 66.97 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.548 -0.461 . . . . 0.0 109.813 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 mt -60.78 -33.04 72.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.984 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -63.39 -33.54 75.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.33 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.08 7.23 38.91 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.358 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.456 ' CB ' ' NZ ' ' A' ' 20' ' ' LYS . 7.8 mtpm? 42.97 49.12 5.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.615 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.438 ' O ' ' OG ' ' A' ' 22' ' ' SER . 13.0 t -72.49 -81.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.695 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.441 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.8 m 168.28 131.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.959 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.1 p -56.26 -28.88 60.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.0 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.63 -40.72 28.6 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.165 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.441 ' OG1' ' O ' ' A' ' 22' ' ' SER . 14.4 p -57.3 -64.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.177 -178.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.3 p -50.55 -31.23 8.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.891 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.0 m -73.19 -29.62 62.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.854 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.668 ' NH2' ' HZ3' ' A' ' 35' ' ' LYS . 58.7 mtp85 -78.16 -19.31 54.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.95 0.405 . . . . 0.0 110.563 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.58 -20.37 0.44 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.754 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.425 ' N ' ' CD1' ' A' ' 30' ' ' LEU . 9.1 mp -103.71 -26.17 12.86 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.37 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.406 ' O ' ' CG ' ' A' ' 32' ' ' ASN . 59.8 mmm -95.63 -56.76 2.58 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.479 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.406 ' CG ' ' O ' ' A' ' 31' ' ' MET . 3.5 m120 -178.71 93.82 0.22 Allowed Pre-proline 0 CA--C 1.54 0.585 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -81.56 86.42 1.59 Allowed 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.923 1.749 . . . . 0.0 112.113 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -113.21 -16.96 12.46 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.638 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.668 ' HZ3' ' NH2' ' A' ' 28' ' ' ARG . 9.6 mptt -82.84 -15.54 51.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.364 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 t -71.69 127.43 33.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.438 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.465 ' O ' ' N ' ' A' ' 41' ' ' ARG . 9.6 t -63.87 147.8 51.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.453 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.52 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 1.9 mp0 -47.19 -53.77 12.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.849 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.38 -52.67 64.26 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.877 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.532 ' HG1' HH21 ' A' ' 43' ' ' ARG . 92.0 m -60.49 -26.41 66.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.599 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 37' ' ' SER . 37.1 ttt85 -70.51 -39.07 74.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.728 -179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -66.04 -33.68 76.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.6 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.532 HH21 ' HG1' ' A' ' 40' ' ' THR . 65.0 mtm180 -68.24 -40.43 82.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.211 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.98 -52.15 64.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.064 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -50.74 -43.63 58.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.572 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -69.95 -38.8 76.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.831 0.348 . . . . 0.0 110.702 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.74 -22.06 44.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.68 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.79 -46.01 63.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.009 0.433 . . . . 0.0 110.567 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 46.1 mtp85 -76.47 -34.56 58.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.943 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -72.16 -39.31 68.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.649 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.8 p -75.28 -23.68 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.995 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.751 0 N-CA-C 111.387 -0.685 . . . . 0.0 111.387 179.592 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.272 0 CA-C-O 120.806 0.336 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.1 m -142.63 145.69 33.74 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.104 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 13.9 ptt? -54.49 -26.25 30.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.577 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -71.23 -36.85 71.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.692 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -69.95 -34.5 73.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.963 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.1 t -64.88 -37.08 79.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.613 -0.435 . . . . 0.0 109.951 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.87 -45.68 67.55 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.1 tp -49.89 -38.44 35.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.949 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -68.12 -38.73 82.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.631 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.11 2.35 56.4 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.179 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.446 ' N ' ' O ' ' A' ' 16' ' ' ALA . 49.9 mttp 45.15 53.41 7.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.576 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.441 ' O ' ' OG ' ' A' ' 22' ' ' SER . 92.4 t -85.83 -83.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.806 -179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 2.9 m 174.84 134.02 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.118 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.3 p -69.0 -28.28 66.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.115 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.23 -39.11 41.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.847 0.356 . . . . 0.0 110.966 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.0 p -57.63 -64.8 0.77 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.078 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 28.1 t -59.56 -27.08 36.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.831 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.9 t -76.65 -39.96 50.61 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.864 -0.335 . . . . 0.0 110.626 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.3 mtt-85 -82.63 -26.75 31.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.935 0.398 . . . . 0.0 110.358 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.501 ' C ' ' H ' ' A' ' 31' ' ' MET . . . -48.43 -47.79 37.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.834 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -56.91 -5.25 0.22 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.253 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.501 ' H ' ' C ' ' A' ' 29' ' ' ALA . 41.0 mtt -121.96 -41.49 2.44 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.883 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -157.27 88.09 2.61 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.642 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -83.1 69.06 7.23 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 122.275 1.983 . . . . 0.0 112.077 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.438 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 33.0 p-10 -119.1 -22.74 7.08 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.044 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -77.73 -24.45 49.09 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.746 0.307 . . . . 0.0 110.786 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.83 135.93 27.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.29 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.554 ' O ' ' N ' ' A' ' 41' ' ' ARG . 10.6 t -67.83 151.95 46.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.272 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.535 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 23.1 mp0 -47.68 -55.48 9.37 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.813 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.54 -52.68 64.13 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.533 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 65.0 m -60.44 -24.58 65.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.933 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.554 ' N ' ' O ' ' A' ' 37' ' ' SER . 30.8 ttp180 -71.28 -35.51 71.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.71 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -74.69 -41.21 60.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.971 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 44.9 ttt85 -62.46 -47.71 82.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.135 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.97 -45.07 99.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.18 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -50.56 -46.76 57.8 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.437 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -70.25 -34.96 73.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.807 0.337 . . . . 0.0 110.682 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.59 -21.97 54.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.784 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.19 -41.57 66.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.876 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -75.32 -36.64 61.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.14 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -69.82 -42.08 74.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.163 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.7 p -75.82 -21.11 15.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.787 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.742 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 179.928 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.229 0 CA-C-O 120.891 0.376 . . . . 0.0 110.389 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.413 ' OG1' ' OD2' ' A' ' 14' ' ' ASP . 8.5 p -63.81 153.28 37.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.52 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 25.0 ttt -51.98 -24.88 7.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.327 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.9 mttp -70.63 -44.02 68.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.232 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.413 ' OD2' ' OG1' ' A' ' 11' ' ' THR . 36.1 m-20 -56.45 -37.56 70.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.259 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.5 t -58.4 -48.36 85.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.104 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.9 -29.48 28.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.673 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.07 -50.55 61.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.495 -179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -76.06 -48.23 21.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.094 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.59 -4.98 25.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.663 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.9 tttt 42.62 47.06 4.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.487 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.443 ' O ' ' OG ' ' A' ' 22' ' ' SER . 19.2 t -69.14 -79.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.278 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 1.6 m 165.66 134.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.245 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.9 m -57.11 -28.54 62.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.629 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.94 -41.47 29.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.865 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 22' ' ' SER . 15.1 p -57.88 -65.15 0.69 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.847 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.4 p -51.37 -33.22 13.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.863 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.9 t -78.17 -35.49 48.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.017 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 -83.28 -20.17 34.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.085 0.469 . . . . 0.0 110.138 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -54.6 -19.56 6.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.394 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.423 ' CD1' ' N ' ' A' ' 30' ' ' LEU . 10.1 mp -88.55 -5.95 57.87 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.635 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 21.3 mmt -121.45 -39.5 2.66 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.844 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -153.95 81.18 4.77 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.634 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -81.55 76.59 4.3 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.379 2.052 . . . . 0.0 111.965 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -158.94 29.25 0.21 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.488 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -121.06 -6.9 9.47 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.608 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.4 t -65.99 133.42 30.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.272 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.542 ' O ' ' N ' ' A' ' 41' ' ' ARG . 1.8 m -50.36 140.35 13.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.319 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -46.92 -53.61 11.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.609 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.31 -52.1 65.79 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.442 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.617 ' HG1' ' NH2' ' A' ' 43' ' ' ARG . 88.1 m -65.19 -22.02 66.84 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.762 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.542 ' N ' ' O ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -70.64 -45.61 64.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.953 0.406 . . . . 0.0 110.249 179.685 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -67.53 -35.87 79.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.917 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.617 ' NH2' ' HG1' ' A' ' 40' ' ' THR . 51.8 mtm180 -68.32 -34.89 76.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.584 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 24.8 t -67.46 -45.95 84.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -51.09 -55.63 16.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.147 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -71.38 -37.61 71.58 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.328 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.38 -22.03 61.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.1 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -72.84 -43.32 62.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.727 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -67.34 -34.62 77.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.575 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -60.07 -48.93 79.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.631 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.7 m -75.73 -8.87 12.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.587 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.668 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.986 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.289 0 CA-C-O 120.771 0.32 . . . . 150.80000000000001 110.343 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.415 ' OG1' ' OD2' ' A' ' 14' ' ' ASP . 7.7 p -145.67 153.4 40.97 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.258 -0.428 . . . . 278.75999999999999 110.053 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 3.2 mtp -52.48 -26.28 12.48 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.679 -0.489 . . . . 972.89999999999998 109.679 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.7 ttmt -71.64 -40.41 69.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.08 -0.509 . . . . 603.35000000000002 110.568 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.415 ' OD2' ' OG1' ' A' ' 11' ' ' THR . 54.2 m-20 -64.41 -33.76 76.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.324 -0.398 . . . . 336.18000000000001 110.471 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.4 t -64.15 -40.03 87.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 174.08000000000001 110.562 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.42 -42.4 64.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.981 0.42 . . . . 107.79000000000001 109.952 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.16 -40.24 80.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.842 -0.617 . . . . 385.97000000000003 109.672 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -67.63 -36.28 80.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 825.65999999999997 110.873 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.18 5.4 50.21 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.929 0.395 . . . . 107.56999999999999 110.207 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 16' ' ' ALA . 82.0 mttt 41.66 47.01 3.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.942 -0.572 . . . . 851.57000000000005 110.73 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.436 ' O ' ' OG ' ' A' ' 22' ' ' SER . 16.8 t -69.61 -80.07 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.888 -0.597 . . . . 186.91999999999999 110.739 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 1.8 m 167.01 131.68 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.041 -0.527 . . . . 154.25 110.097 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.2 m -57.36 -28.69 63.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.202 -0.454 . . . . 331.81999999999999 110.929 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.16 -40.87 29.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.819 0.342 . . . . 124.91 111.135 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.435 ' OG1' ' O ' ' A' ' 22' ' ' SER . 14.3 p -57.6 -64.69 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.161 -0.472 . . . . 102.61 110.048 -179.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.5 p -54.48 -31.94 23.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.377 -0.374 . . . . 302.57999999999998 111.093 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.2 t -73.65 -36.7 65.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.342 -0.39 . . . . 260.91000000000003 111.071 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -82.2 -19.42 39.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.991 0.425 . . . . 999.99000000000001 110.365 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.29 -19.8 5.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.828 -0.624 . . . . 209.84 111.153 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.2 mt -88.09 -9.6 52.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.709 0.29 . . . . 799.29999999999995 110.862 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 7.5 mmt -115.99 -38.39 3.65 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.46 -0.336 . . . . 455.36000000000001 110.735 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -155.89 87.1 3.08 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 492.02999999999997 110.479 -179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.83 73.15 6.15 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 122.162 1.908 . . . . 277.31 112.075 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -155.05 26.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.955 -0.566 . . . . 999.99000000000001 110.426 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -111.89 -19.99 12.19 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.128 -0.487 . . . . 999.99000000000001 110.135 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.1 t -65.97 143.17 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.055 -0.52 . . . . 342.27999999999997 110.432 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.538 ' O ' ' N ' ' A' ' 41' ' ' ARG . 5.6 t -61.16 145.44 51.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 275.69 110.32 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -47.71 -52.23 19.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.164 -0.471 . . . . 913.66999999999996 110.966 -179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.87 -52.87 62.38 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.229 -0.589 . . . . 173.06 110.229 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 72.1 m -65.17 -22.36 66.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.16 -0.473 . . . . 166.53 110.896 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 37' ' ' SER . 63.0 ttt180 -71.23 -41.34 70.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 999.99000000000001 110.846 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -68.14 -32.02 72.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.897 0.379 . . . . 639.24000000000001 110.762 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.6 mtp180 -69.39 -46.01 67.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.099 -0.5 . . . . 739.13999999999999 109.983 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.68 -50.73 78.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.941 -0.572 . . . . 323.55000000000001 110.235 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -50.57 -50.53 53.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.254 -0.43 . . . . 357.44999999999999 110.829 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -70.21 -34.97 73.56 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.887 -0.325 . . . . 881.86000000000001 110.561 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.61 -22.08 61.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.438 . . . . 189.5 110.53 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.36 -46.37 88.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.442 . . . . 143.63999999999999 110.534 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -75.78 -34.58 60.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 999.99000000000001 110.881 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -59.49 -45.83 90.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.362 -0.381 . . . . 396.76999999999998 111.326 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.5 p -75.35 -16.7 15.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 C-N-CA 120.853 -0.339 . . . . 379.91000000000003 110.723 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.685 0 N-CA-C 111.474 -0.65 . . . . 130.71000000000001 111.474 179.443 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -83.72 178.83 7.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.471 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.8 m -143.55 148.69 36.33 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.361 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 10.5 ptt? -53.62 -27.26 26.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.708 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.4 ttmt -72.54 -41.88 65.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.662 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -63.07 -34.74 78.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.479 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 54.3 t -64.59 -37.44 80.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.589 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.55 -46.18 66.69 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.007 0.432 . . . . 0.0 110.006 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.4 mt -66.98 -39.35 87.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.306 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -65.02 -32.47 74.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.983 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.39 12.7 31.28 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.76 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt 35.46 47.9 0.38 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.319 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.429 ' O ' ' OG ' ' A' ' 22' ' ' SER . 11.4 t -69.03 -79.99 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.814 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.438 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.6 m 167.09 129.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.267 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.2 t -51.55 -29.7 17.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.972 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.55 -41.23 27.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.864 0.364 . . . . 0.0 111.227 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.438 ' OG1' ' O ' ' A' ' 22' ' ' SER . 15.8 p -57.68 -64.88 0.75 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.85 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.4 p -50.87 -34.68 13.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.721 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.9 t -76.63 -32.52 58.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.78 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 31' ' ' MET . 52.4 mmt-85 -82.45 -19.54 38.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.131 0.491 . . . . 0.0 110.103 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.79 -20.04 0.44 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.005 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 pp -102.61 -16.04 16.19 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.718 0.294 . . . . 0.0 110.484 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.409 ' N ' ' O ' ' A' ' 28' ' ' ARG . 41.6 mtt -100.28 -53.5 3.1 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.476 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -143.97 83.37 10.37 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.347 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -80.93 63.06 8.74 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.278 1.986 . . . . 0.0 112.039 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -154.85 34.69 0.4 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.433 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -124.32 -14.73 6.89 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.31 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 97.2 t -65.88 144.56 14.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.066 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.519 ' O ' ' N ' ' A' ' 41' ' ' ARG . 5.6 t -59.6 144.9 46.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.163 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -47.7 -53.85 13.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.637 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.06 -53.15 61.15 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.364 -0.534 . . . . 0.0 109.812 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 86.5 m -62.18 -24.7 67.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.836 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' A' ' 37' ' ' SER . 41.6 ttp180 -70.57 -42.84 70.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.673 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.0 t-20 -65.61 -33.67 76.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.729 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -68.71 -43.38 76.12 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.947 0.403 . . . . 0.0 110.254 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 47.4 t -58.37 -50.55 78.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.155 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -50.61 -50.08 54.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.613 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -70.24 -39.56 74.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.779 0.324 . . . . 0.0 110.672 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.7 -23.54 66.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.736 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.472 ' O ' ' N ' ' A' ' 52' ' ' GLY . . . -73.02 -38.35 66.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.782 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -68.27 -38.0 81.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.927 0.394 . . . . 0.0 110.362 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -59.4 -51.02 71.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.217 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 72.1 t -82.53 -24.45 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.698 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.472 ' N ' ' O ' ' A' ' 48' ' ' ALA . . . 42.35 38.45 2.82 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 112.132 -0.387 . . . . 0.0 112.132 179.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -140.73 114.71 9.08 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.898 0.349 . . . . 0.0 110.087 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.41 65.6 3.97 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.423 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo . . . . . 0 C--N 1.308 -1.582 0 C-N-CA 122.662 2.241 . . . . 0.0 112.142 179.955 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -100.06 168.01 10.11 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.313 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.4 m -143.66 148.96 36.55 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.226 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 11.5 tpt -48.26 -30.0 4.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.691 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -74.55 -42.01 59.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.693 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -62.0 -34.51 76.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.87 0.367 . . . . 0.0 110.588 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.5 t -62.03 -40.51 87.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.259 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.494 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.86 -41.77 64.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.409 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.6 tp -59.95 -42.86 94.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.322 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -63.89 -33.32 75.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.769 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.65 5.68 36.57 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.753 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 16' ' ' ALA . 65.9 mttm 41.41 46.98 3.04 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.078 0.466 . . . . 0.0 110.641 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 80.0 t -70.07 -81.87 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.137 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.431 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.5 t 171.36 129.74 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.335 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 35.6 m -62.92 -28.61 70.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.728 -179.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.42 ' O ' ' OG ' ' A' ' 27' ' ' SER . . . -79.65 -38.85 32.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.918 0.39 . . . . 0.0 111.253 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' A' ' 22' ' ' SER . 17.9 p -56.63 -64.48 0.86 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.838 -178.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.9 t -51.54 -25.52 5.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.481 ' HG ' ' N ' ' A' ' 28' ' ' ARG . 4.2 p -77.15 -31.49 55.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.377 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' A' ' 32' ' ' ASN . 97.4 mtt180 -82.07 -19.48 40.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.217 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.46 -19.92 0.99 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.108 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.436 ' CD1' ' N ' ' A' ' 30' ' ' LEU . 9.7 mp -97.12 -12.28 23.32 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.564 0.221 . . . . 0.0 110.924 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 20.2 mmt -121.62 -52.08 2.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.803 0.335 . . . . 0.0 110.894 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 28' ' ' ARG . 9.6 t-20 -130.22 80.6 70.38 Favored Pre-proline 0 N--CA 1.466 0.339 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.382 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.99 61.61 7.88 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 C-N-CA 122.475 2.117 . . . . 0.0 112.298 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -161.68 44.53 0.16 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.622 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -127.18 -20.69 4.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.632 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.1 t -66.59 141.93 17.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.536 ' O ' ' N ' ' A' ' 41' ' ' ARG . 1.6 m -58.43 143.3 45.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.791 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -47.48 -53.87 13.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.739 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.49 -52.26 66.4 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.805 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.5 m -64.68 -22.01 66.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.887 179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.536 ' N ' ' O ' ' A' ' 37' ' ' SER . 16.9 tpt180 -71.01 -42.21 69.88 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.614 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.517 HD21 ' N ' ' A' ' 42' ' ' ASN . 1.2 m-80 -68.76 -36.32 78.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.864 0.364 . . . . 0.0 110.765 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 45.3 ttm-85 -68.11 -44.14 76.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.107 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.511 ' O ' ' N ' ' A' ' 48' ' ' ALA . 37.2 t -58.88 -48.89 84.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.911 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.6 tt0 -50.11 -50.82 47.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.61 -179.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -70.3 -35.53 73.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.85 0.357 . . . . 0.0 110.576 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.81 -23.61 60.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.409 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -68.01 -39.2 83.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.61 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -71.87 -34.51 69.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.331 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -53.84 -50.71 65.61 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.546 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.4 p -79.43 -8.24 11.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.535 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 52.37 28.61 28.34 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 111.647 -0.581 . . . . 0.0 111.647 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -140.77 114.4 8.84 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.472 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.6 OUTLIER -156.91 50.57 0.45 Allowed Pre-proline 0 C--N 1.332 -0.19 0 CA-C-O 120.793 0.33 . . . . 0.0 111.114 -179.776 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.472 ' CD ' ' N ' ' A' ' 54' ' ' LEU . 55.5 Cg_endo . . . . . 0 C--N 1.306 -1.66 0 C-N-CA 122.588 2.192 . . . . 0.0 111.829 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -90.03 179.72 5.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.464 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.0 m -146.33 149.56 34.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.367 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 63.3 mtt -50.89 -25.27 4.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.481 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -75.57 -43.25 49.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.951 -179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -62.35 -33.95 75.7 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.636 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 77.8 t -65.15 -37.39 80.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.591 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.36 -45.2 65.65 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.7 tp -54.09 -41.5 68.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.32 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -69.9 -42.83 72.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.028 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.61 -0.38 37.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.153 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp 42.91 33.43 0.5 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.974 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -74.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.131 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 2.0 t 172.35 139.37 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.352 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.8 m -67.66 -28.87 68.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.045 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.415 ' O ' ' OG ' ' A' ' 27' ' ' SER . . . -78.08 -38.31 44.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.977 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.0 p -57.62 -64.85 0.76 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.129 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.3 p -50.81 -27.67 5.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.191 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 24' ' ' ALA . 60.3 p -82.75 -34.78 27.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.047 -179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.0 mtt-85 -81.81 -30.48 32.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.853 0.358 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.519 ' C ' ' H ' ' A' ' 31' ' ' MET . . . -53.97 -54.91 32.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.615 -179.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.7 mt -49.77 -10.25 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.843 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.519 ' H ' ' C ' ' A' ' 29' ' ' ALA . 15.6 mmt -115.33 -36.16 4.41 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.857 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' A' ' 34' ' ' ASP . 25.6 m120 -156.01 81.94 3.68 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.822 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -63.33 54.62 0.16 Allowed 'Trans proline' 0 N--CA 1.501 1.928 0 C-N-CA 122.97 2.447 . . . . 0.0 112.451 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' ASN . 19.6 t70 -122.94 -29.56 3.92 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.979 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -66.6 -23.55 66.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.755 0.312 . . . . 0.0 110.735 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.0 m -69.03 139.57 20.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.413 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.522 ' O ' ' N ' ' A' ' 41' ' ' ARG . 58.6 m -71.72 159.31 34.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.228 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -47.06 -58.61 3.83 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.224 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.83 -52.89 63.31 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.099 -0.64 . . . . 0.0 109.452 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 53.4 m -58.52 -25.64 62.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.711 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 37' ' ' SER . 20.1 ttm180 -70.47 -39.32 74.31 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.874 0.369 . . . . 0.0 110.4 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -71.49 -45.55 62.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.942 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.6 ttm180 -63.43 -43.33 97.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.951 0.405 . . . . 0.0 110.067 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.1 t -60.18 -51.83 68.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.851 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -51.0 -44.76 60.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.849 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 55.5 mttm -70.07 -38.26 75.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.669 0.271 . . . . 0.0 110.713 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.42 -22.61 44.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.75 -179.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.09 -44.74 79.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.834 0.35 . . . . 0.0 110.468 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -76.44 -43.6 39.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.964 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 60.1 tt0 -59.57 -42.71 93.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.702 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.3 p -75.6 -22.83 16.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.964 -179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 48.44 56.97 8.71 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -79.52 115.79 19.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.973 0.416 . . . . 0.0 110.231 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.636 ' H ' ' CD ' ' A' ' 55' ' ' PRO . 11.6 mt -115.57 -34.89 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.431 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.605 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.636 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 53.1 Cg_exo . . . . . 0 N--CA 1.496 1.652 0 C-N-CA 121.888 1.725 . . . . 0.0 112.122 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -104.34 83.73 2.1 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.405 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.3 p -57.79 155.52 10.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.365 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.506 ' SD ' ' CD2' ' A' ' 53' ' ' TYR . 70.4 mtp -48.86 -24.69 1.54 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.203 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.45 ' NZ ' ' CB ' ' A' ' 13' ' ' LYS . 8.5 mtmp? -72.44 -42.97 64.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.461 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -57.61 -38.37 74.82 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.821 0.343 . . . . 0.0 110.394 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.53 -47.05 89.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.408 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.58 -29.92 28.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.405 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.82 -48.08 75.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.055 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -71.3 -37.77 71.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.08 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -88.84 -1.8 58.27 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.864 0.364 . . . . 0.0 110.434 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.46 ' N ' ' O ' ' A' ' 16' ' ' ALA . 40.7 mtmt 43.32 47.25 5.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.705 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' A' ' 22' ' ' SER . 30.2 t -70.05 -79.54 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.662 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.442 ' OG ' ' CG2' ' A' ' 25' ' ' THR . 1.0 OUTLIER 165.78 134.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.111 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.6 m -60.88 -27.87 68.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.425 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.71 -40.93 39.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.836 0.35 . . . . 0.0 111.073 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.442 ' CG2' ' OG ' ' A' ' 22' ' ' SER . 12.3 p -58.33 -65.53 0.64 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.926 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.42 ' H ' ' HG1' ' A' ' 25' ' ' THR . 4.9 p -53.73 -33.91 23.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.997 -179.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.8 t -75.02 -37.1 61.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.682 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.3 mmt85 -82.46 -20.43 36.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.287 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -70.96 -20.5 62.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.896 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.7 mt -61.61 -25.58 67.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.72 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 67.3 mtm -122.35 -14.59 7.84 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.852 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -151.69 82.23 5.65 Favored Pre-proline 0 N--CA 1.464 0.25 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.638 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -79.9 73.92 5.79 Favored 'Trans proline' 0 N--CA 1.492 1.427 0 C-N-CA 122.203 1.935 . . . . 0.0 112.123 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -160.6 28.99 0.16 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.52 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -106.6 -23.19 12.53 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.422 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.6 m -65.75 145.59 13.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.943 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.568 ' O ' ' N ' ' A' ' 41' ' ' ARG . 16.1 t -64.22 153.66 37.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.141 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.504 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 3.1 mp0 -46.81 -56.43 6.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.851 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.39 -51.9 67.92 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 119.944 -0.703 . . . . 0.0 109.654 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 97.2 m -63.06 -21.81 66.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.248 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.568 ' N ' ' O ' ' A' ' 37' ' ' SER . 32.9 ttp180 -71.45 -37.38 71.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.906 0.384 . . . . 0.0 110.967 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -74.56 -39.18 62.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.063 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -64.34 -48.1 76.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.024 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 34.1 m -62.2 -45.13 99.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.042 -179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -51.04 -50.64 58.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.88 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.1 mmtp -71.62 -33.77 69.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.851 0.358 . . . . 0.0 111.108 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.32 -21.81 61.27 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.074 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.15 -37.86 72.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.803 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -72.65 -38.72 67.58 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.432 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -54.72 -45.78 74.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.742 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.3 m -75.78 -0.8 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.646 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 45.0 52.03 8.18 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.174 -0.771 . . . . 0.0 111.174 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.506 ' CD2' ' SD ' ' A' ' 12' ' ' MET . 77.5 t80 -82.29 129.67 34.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.764 0.316 . . . . 0.0 110.409 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.2 mt -132.31 151.53 78.48 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.013 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo . . . . . 0 N--CA 1.494 1.533 0 C-N-CA 122.171 1.914 . . . . 0.0 111.868 179.935 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -115.77 82.93 1.85 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.335 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.3 p -61.01 168.81 2.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.398 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.3 ttt -57.09 -24.81 56.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.279 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -68.4 -40.33 81.33 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.193 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -63.3 -36.98 85.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.49 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 92.9 t -58.27 -45.18 89.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.748 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.73 -40.24 62.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.989 0.423 . . . . 0.0 110.401 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.2 tp -56.55 -45.76 81.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.8 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -69.01 -33.94 74.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.293 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.14 -1.39 57.75 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.696 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 46.12 45.61 12.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.977 0.417 . . . . 0.0 110.64 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.41 ' O ' ' CB ' ' A' ' 22' ' ' SER . 21.6 t -69.61 -78.11 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.089 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.438 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.5 t 165.92 136.79 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.422 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.0 m -61.75 -28.07 69.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.067 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.86 -39.84 42.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.819 0.342 . . . . 0.0 111.067 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.438 ' OG1' ' O ' ' A' ' 22' ' ' SER . 19.9 p -57.66 -65.13 0.68 Allowed 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.791 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.9 p -52.3 -31.4 14.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.784 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.5 t -76.2 -36.13 58.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.724 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -79.36 -19.46 50.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.019 0.438 . . . . 0.0 110.276 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.01 -20.04 61.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.693 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 23.7 mt -63.25 -22.31 66.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.403 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 8.3 ptp -121.59 -13.1 8.42 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.581 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -152.24 68.6 7.28 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.505 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.66 161.56 19.12 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.895 2.396 . . . . 0.0 112.337 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 78.38 25.38 0.58 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.473 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -127.07 17.66 7.2 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.319 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 17.4 m -77.02 162.63 4.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.466 ' O ' ' N ' ' A' ' 41' ' ' ARG . 40.9 t -46.13 146.46 1.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.903 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.428 ' CG ' ' N ' ' A' ' 39' ' ' ALA . 14.7 pt20 -47.49 -44.95 25.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.604 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.428 ' N ' ' CG ' ' A' ' 38' ' ' GLN . . . -63.02 -52.93 60.98 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.446 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 85.2 m -64.44 -22.55 66.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.618 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.466 ' N ' ' O ' ' A' ' 37' ' ' SER . 33.5 ttt85 -70.05 -44.9 68.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.032 0.444 . . . . 0.0 110.183 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -74.54 -43.67 54.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.875 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 63.1 mtp180 -65.8 -43.56 88.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.607 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.3 p -65.05 -41.24 91.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 119.842 -0.743 . . . . 0.0 110.327 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -51.26 -50.69 58.73 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.558 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -71.58 -35.48 70.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.838 0.352 . . . . 0.0 111.068 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.18 -21.21 65.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.21 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.03 -47.35 59.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.869 0.366 . . . . 0.0 110.494 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -74.0 -41.7 61.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.922 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -60.61 -50.51 73.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.851 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 45.4 t -76.41 -6.45 8.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.026 0.441 . . . . 0.0 110.334 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.77 52.87 50.39 Favored Glycine 0 CA--C 1.526 0.741 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.625 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -93.32 130.39 39.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.777 0.322 . . . . 0.0 110.328 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.7 mt -131.5 152.22 80.09 Favored Pre-proline 0 N--CA 1.467 0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.831 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo . . . . . 0 N--CA 1.496 1.652 0 C-N-CA 122.148 1.899 . . . . 0.0 111.845 179.841 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -84.41 157.83 21.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.528 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 p -143.58 146.96 33.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.971 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.1 ptm -47.95 -26.25 1.67 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.917 0.389 . . . . 0.0 110.417 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -78.66 -47.26 17.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.568 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -57.61 -36.69 72.12 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 120.872 0.367 . . . . 0.0 110.555 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.6 t -58.42 -45.13 89.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.592 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.73 -41.2 63.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.753 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.7 mt -76.06 -45.27 35.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.588 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.55 -42.97 84.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.876 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.96 16.65 24.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.672 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.9 pttm 35.88 47.74 0.44 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.104 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.401 ' O ' ' CB ' ' A' ' 22' ' ' SER . 17.2 t -68.67 -78.01 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.593 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.401 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.4 t 168.58 138.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.496 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 26.1 m -68.29 -28.04 66.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.818 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.9 -43.8 24.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.837 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.441 ' O ' ' N ' ' A' ' 29' ' ' ALA . 53.0 p -58.21 -65.04 0.71 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.144 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p -50.95 -29.37 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.069 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.6 m -82.08 -36.94 27.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.751 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -82.78 -19.58 37.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.282 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.441 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -48.87 -53.63 18.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.597 -179.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.02 -10.02 57.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.073 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 41.1 mtp -94.17 -52.09 4.53 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.041 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -160.83 86.9 1.76 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.753 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -47.7 107.09 0.12 Allowed 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.404 2.069 . . . . 0.0 111.894 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.539 ' C ' ' H ' ' A' ' 36' ' ' VAL . 29.4 t70 -176.74 -31.22 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.569 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.2 mmmm -66.12 11.37 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.51 -178.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.539 ' H ' ' C ' ' A' ' 34' ' ' ASP . 3.5 m -107.38 127.93 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.541 ' O ' ' N ' ' A' ' 41' ' ' ARG . 39.6 t -72.42 164.59 26.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.534 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -47.6 -54.92 10.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.329 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.33 -53.35 59.27 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.575 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 52.0 m -62.2 -23.26 66.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.045 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -71.26 -44.78 64.6 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.296 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -70.02 -42.68 72.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.12 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 71.3 mtp85 -65.36 -45.36 84.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 110.252 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 28.0 t -60.15 -48.13 89.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.054 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -51.14 -51.67 51.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.739 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -70.23 -39.94 74.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.798 0.333 . . . . 0.0 110.87 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.95 -23.05 61.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.889 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.58 -39.36 64.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.6 ttp180 -69.85 -35.26 74.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.027 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -55.88 -49.86 72.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.47 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.43 ' C ' ' H ' ' A' ' 53' ' ' TYR . 7.9 p -75.42 -7.16 9.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.782 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.77 -31.19 2.24 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.43 ' H ' ' C ' ' A' ' 51' ' ' VAL . 9.5 m-85 -80.65 114.79 19.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.8 mt -103.57 148.6 36.0 Favored Pre-proline 0 CA--C 1.533 0.322 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo . . . . . 0 N--CA 1.494 1.51 0 C-N-CA 121.977 1.785 . . . . 0.0 111.955 179.92 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.06 174.29 11.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.431 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.0 p -140.65 145.45 36.61 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.159 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 22.4 ttt -59.87 -25.17 64.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.633 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -71.78 -46.73 57.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.208 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -61.93 -33.02 73.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.423 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 52.4 t -61.47 -45.98 97.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.612 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.54 -37.47 57.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.528 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.94 -46.35 88.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.022 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -66.54 -33.96 76.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.038 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.64 5.9 50.08 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.381 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.5 ttmt 41.2 45.35 2.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.993 0.425 . . . . 0.0 110.669 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.436 ' O ' ' CB ' ' A' ' 22' ' ' SER . 21.2 t -69.46 -78.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.795 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.6 m 165.87 136.69 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.139 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.6 p -64.65 -28.44 69.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.0 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.03 -40.99 29.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.058 0.456 . . . . 0.0 110.706 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.585 ' HG1' ' H ' ' A' ' 26' ' ' VAL . 18.6 p -57.15 -64.25 0.94 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.165 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.585 ' H ' ' HG1' ' A' ' 25' ' ' THR . 5.7 p -50.15 -27.02 3.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.825 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.7 m -80.13 -32.06 38.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -82.09 -19.37 40.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.179 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.17 -19.47 64.0 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.58 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.2 mt -86.63 -15.63 39.13 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.204 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.1 mmt -100.31 -32.2 10.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.416 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.443 ' CB ' ' HZ3' ' A' ' 35' ' ' LYS . 25.6 m120 -160.18 147.42 12.5 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.435 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.53 -45.12 0.13 Allowed 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.257 1.971 . . . . 0.0 112.253 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -69.65 55.41 0.12 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.42 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.443 ' HZ3' ' CB ' ' A' ' 32' ' ' ASN . 39.5 mmtm -127.41 -5.8 5.92 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.902 0.382 . . . . 0.0 110.303 179.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.1 m -104.52 142.79 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.282 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.525 ' O ' ' N ' ' A' ' 41' ' ' ARG . 39.6 m -66.01 160.01 24.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.168 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.559 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -47.42 -48.49 26.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.41 -179.427 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.43 -53.16 56.64 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.221 -0.592 . . . . 0.0 109.643 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.7 m -62.3 -22.88 66.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.774 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.525 ' N ' ' O ' ' A' ' 37' ' ' SER . 56.9 ttt180 -71.46 -44.2 65.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.613 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -72.32 -42.78 65.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.465 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -65.12 -45.06 86.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.836 0.351 . . . . 0.0 110.591 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 25.4 t -60.79 -45.57 97.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.987 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -50.95 -52.52 41.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.68 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -71.69 -38.07 70.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.726 0.298 . . . . 0.0 111.071 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.61 -22.21 61.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.92 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.15 -42.8 62.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.422 ' CA ' ' HE ' ' A' ' 49' ' ' ARG . 0.0 OUTLIER -64.74 -34.78 79.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.313 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -53.49 -50.45 65.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.189 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.4 t -90.95 -3.35 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.111 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 44.67 40.29 6.45 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 111.624 -0.59 . . . . 0.0 111.624 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -140.26 115.49 9.87 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.675 0.274 . . . . 0.0 110.669 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.61 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 5.5 mt -108.68 -34.74 0.16 Allowed Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.178 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.61 ' CD ' ' N ' ' A' ' 54' ' ' LEU . 52.1 Cg_exo . . . . . 0 N--CA 1.496 1.654 0 C-N-CA 121.877 1.718 . . . . 0.0 112.032 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -87.34 173.49 9.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.499 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.5 p -140.83 146.41 37.54 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.175 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.592 ' SD ' ' CD2' ' A' ' 53' ' ' TYR . 27.2 mtm -56.9 -24.86 55.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.6 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 53.2 mttm -71.88 -41.62 67.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.889 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -66.28 -37.51 85.61 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.046 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 74.9 t -67.25 -32.63 58.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.476 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.59 -46.53 66.97 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.548 -0.461 . . . . 0.0 109.813 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 mt -60.78 -33.04 72.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.984 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -63.39 -33.54 75.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.33 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.08 7.23 38.91 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.358 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.456 ' CB ' ' NZ ' ' A' ' 20' ' ' LYS . 7.8 mtpm? 42.97 49.12 5.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.615 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.438 ' O ' ' OG ' ' A' ' 22' ' ' SER . 13.0 t -72.49 -81.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.695 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.441 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.8 m 168.28 131.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.959 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.1 p -56.26 -28.88 60.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.0 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.63 -40.72 28.6 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.165 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.441 ' OG1' ' O ' ' A' ' 22' ' ' SER . 14.4 p -57.3 -64.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.177 -178.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.3 p -50.55 -31.23 8.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.891 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.0 m -73.19 -29.62 62.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.854 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.668 ' NH2' ' HZ3' ' A' ' 35' ' ' LYS . 58.7 mtp85 -78.16 -19.31 54.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.95 0.405 . . . . 0.0 110.563 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.58 -20.37 0.44 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.754 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.425 ' N ' ' CD1' ' A' ' 30' ' ' LEU . 9.1 mp -103.71 -26.17 12.86 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.37 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.406 ' O ' ' CG ' ' A' ' 32' ' ' ASN . 59.8 mmm -95.63 -56.76 2.58 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.479 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.406 ' CG ' ' O ' ' A' ' 31' ' ' MET . 3.5 m120 -178.71 93.82 0.22 Allowed Pre-proline 0 CA--C 1.54 0.585 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -81.56 86.42 1.59 Allowed 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.923 1.749 . . . . 0.0 112.113 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -113.21 -16.96 12.46 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.638 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.668 ' HZ3' ' NH2' ' A' ' 28' ' ' ARG . 9.6 mptt -82.84 -15.54 51.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.364 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 t -71.69 127.43 33.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.438 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.465 ' O ' ' N ' ' A' ' 41' ' ' ARG . 9.6 t -63.87 147.8 51.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.453 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.52 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 1.9 mp0 -47.19 -53.77 12.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.849 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.38 -52.67 64.26 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.877 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.532 ' HG1' HH21 ' A' ' 43' ' ' ARG . 92.0 m -60.49 -26.41 66.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.599 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 37' ' ' SER . 37.1 ttt85 -70.51 -39.07 74.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.728 -179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -66.04 -33.68 76.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.6 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.532 HH21 ' HG1' ' A' ' 40' ' ' THR . 65.0 mtm180 -68.24 -40.43 82.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.211 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.98 -52.15 64.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.064 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -50.74 -43.63 58.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.572 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -69.95 -38.8 76.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.831 0.348 . . . . 0.0 110.702 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.74 -22.06 44.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.68 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.79 -46.01 63.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.009 0.433 . . . . 0.0 110.567 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 46.1 mtp85 -76.47 -34.56 58.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.943 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -72.16 -39.31 68.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.649 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 5.8 p -75.28 -23.68 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.995 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.56 43.01 8.07 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 111.387 -0.685 . . . . 0.0 111.387 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.592 ' CD2' ' SD ' ' A' ' 12' ' ' MET . 76.8 t80 -94.42 122.16 36.71 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.2 mt -114.23 150.83 44.32 Favored Pre-proline 0 N--CA 1.468 0.442 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.079 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo . . . . . 0 N--CA 1.495 1.563 0 C-N-CA 122.11 1.873 . . . . 0.0 111.808 179.946 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.11 -175.79 3.8 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.454 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.1 m -142.63 145.69 33.74 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.104 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 13.9 ptt? -54.49 -26.25 30.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.577 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.7 ttpt -71.23 -36.85 71.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.692 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -69.95 -34.5 73.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.963 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.1 t -64.88 -37.08 79.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.613 -0.435 . . . . 0.0 109.951 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.87 -45.68 67.55 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.1 tp -49.89 -38.44 35.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.949 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -68.12 -38.73 82.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.631 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.11 2.35 56.4 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.179 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.446 ' N ' ' O ' ' A' ' 16' ' ' ALA . 49.9 mttp 45.15 53.41 7.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.576 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.441 ' O ' ' OG ' ' A' ' 22' ' ' SER . 92.4 t -85.83 -83.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.806 -179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 2.9 m 174.84 134.02 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.118 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.3 p -69.0 -28.28 66.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.115 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.23 -39.11 41.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.847 0.356 . . . . 0.0 110.966 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.0 p -57.63 -64.8 0.77 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.078 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 28.1 t -59.56 -27.08 36.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.831 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.9 t -76.65 -39.96 50.61 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.864 -0.335 . . . . 0.0 110.626 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.3 mtt-85 -82.63 -26.75 31.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.935 0.398 . . . . 0.0 110.358 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.501 ' C ' ' H ' ' A' ' 31' ' ' MET . . . -48.43 -47.79 37.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.834 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -56.91 -5.25 0.22 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.253 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.501 ' H ' ' C ' ' A' ' 29' ' ' ALA . 41.0 mtt -121.96 -41.49 2.44 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.883 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -157.27 88.09 2.61 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.642 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -83.1 69.06 7.23 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 122.275 1.983 . . . . 0.0 112.077 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.438 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 33.0 p-10 -119.1 -22.74 7.08 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.044 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -77.73 -24.45 49.09 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.746 0.307 . . . . 0.0 110.786 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.83 135.93 27.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.29 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.554 ' O ' ' N ' ' A' ' 41' ' ' ARG . 10.6 t -67.83 151.95 46.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.272 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.535 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 23.1 mp0 -47.68 -55.48 9.37 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.813 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.54 -52.68 64.13 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.533 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 65.0 m -60.44 -24.58 65.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.933 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.554 ' N ' ' O ' ' A' ' 37' ' ' SER . 30.8 ttp180 -71.28 -35.51 71.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.71 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -74.69 -41.21 60.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.971 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 44.9 ttt85 -62.46 -47.71 82.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.135 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 33.7 m -62.97 -45.07 99.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.18 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -50.56 -46.76 57.8 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.437 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -70.25 -34.96 73.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.807 0.337 . . . . 0.0 110.682 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.59 -21.97 54.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.784 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.19 -41.57 66.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.876 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -75.32 -36.64 61.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.14 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -69.82 -42.08 74.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.163 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.7 p -75.82 -21.11 15.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.787 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 45.94 56.53 6.7 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -76.48 122.08 24.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.775 0.322 . . . . 0.0 110.376 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.1 mt -137.91 152.02 71.4 Favored Pre-proline 0 N--CA 1.465 0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.081 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo . . . . . 0 N--CA 1.494 1.514 0 C-N-CA 122.278 1.985 . . . . 0.0 111.879 179.878 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -95.57 114.78 26.57 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.389 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.413 ' OG1' ' OD2' ' A' ' 14' ' ' ASP . 8.5 p -63.81 153.28 37.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.52 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 25.0 ttt -51.98 -24.88 7.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.327 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.9 mttp -70.63 -44.02 68.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.232 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' OD2' ' OG1' ' A' ' 11' ' ' THR . 36.1 m-20 -56.45 -37.56 70.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.259 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.5 t -58.4 -48.36 85.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.104 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.9 -29.48 28.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.673 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.07 -50.55 61.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.495 -179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -76.06 -48.23 21.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.094 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.59 -4.98 25.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.663 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.9 tttt 42.62 47.06 4.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.487 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.443 ' O ' ' OG ' ' A' ' 22' ' ' SER . 19.2 t -69.14 -79.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.278 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 1.6 m 165.66 134.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.245 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.9 m -57.11 -28.54 62.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.629 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.94 -41.47 29.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.865 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 22' ' ' SER . 15.1 p -57.88 -65.15 0.69 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.847 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.4 p -51.37 -33.22 13.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.863 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.9 t -78.17 -35.49 48.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.017 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 -83.28 -20.17 34.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.085 0.469 . . . . 0.0 110.138 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -54.6 -19.56 6.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.394 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.423 ' CD1' ' N ' ' A' ' 30' ' ' LEU . 10.1 mp -88.55 -5.95 57.87 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.635 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 21.3 mmt -121.45 -39.5 2.66 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.844 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -153.95 81.18 4.77 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.634 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -81.55 76.59 4.3 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.379 2.052 . . . . 0.0 111.965 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -158.94 29.25 0.21 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.488 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -121.06 -6.9 9.47 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.608 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.4 t -65.99 133.42 30.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.272 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.542 ' O ' ' N ' ' A' ' 41' ' ' ARG . 1.8 m -50.36 140.35 13.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.319 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -46.92 -53.61 11.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.609 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.31 -52.1 65.79 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.442 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.617 ' HG1' ' NH2' ' A' ' 43' ' ' ARG . 88.1 m -65.19 -22.02 66.84 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.762 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.542 ' N ' ' O ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -70.64 -45.61 64.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.953 0.406 . . . . 0.0 110.249 179.685 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -67.53 -35.87 79.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.917 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.617 ' NH2' ' HG1' ' A' ' 40' ' ' THR . 51.8 mtm180 -68.32 -34.89 76.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.584 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 24.8 t -67.46 -45.95 84.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -51.09 -55.63 16.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.147 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -71.38 -37.61 71.58 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.328 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.38 -22.03 61.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.1 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -72.84 -43.32 62.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.727 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -67.34 -34.62 77.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.575 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -60.07 -48.93 79.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.631 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.7 m -75.73 -8.87 12.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.587 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 49.76 53.75 20.41 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -80.67 133.97 35.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.779 0.323 . . . . 0.0 110.39 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.2 mt -136.94 151.59 72.49 Favored Pre-proline 0 N--CA 1.465 0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.999 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo . . . . . 0 N--CA 1.495 1.565 0 C-N-CA 122.21 1.94 . . . . 0.0 111.876 179.919 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.406 -0.591 . . . . 436.14999999999998 109.406 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -101.56 -172.62 2.19 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.116 -0.493 . . . . 150.80000000000001 110.343 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.415 ' OG1' ' OD2' ' A' ' 14' ' ' ASP . 7.7 p -145.67 153.4 40.97 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.258 -0.428 . . . . 278.75999999999999 110.053 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 3.2 mtp -52.48 -26.28 12.48 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.679 -0.489 . . . . 972.89999999999998 109.679 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.7 ttmt -71.64 -40.41 69.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.08 -0.509 . . . . 603.35000000000002 110.568 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.415 ' OD2' ' OG1' ' A' ' 11' ' ' THR . 54.2 m-20 -64.41 -33.76 76.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.324 -0.398 . . . . 336.18000000000001 110.471 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.4 t -64.15 -40.03 87.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 174.08000000000001 110.562 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.42 -42.4 64.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.981 0.42 . . . . 107.79000000000001 109.952 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.16 -40.24 80.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.842 -0.617 . . . . 385.97000000000003 109.672 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -67.63 -36.28 80.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 825.65999999999997 110.873 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.18 5.4 50.21 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.929 0.395 . . . . 107.56999999999999 110.207 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 16' ' ' ALA . 82.0 mttt 41.66 47.01 3.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.942 -0.572 . . . . 851.57000000000005 110.73 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.436 ' O ' ' OG ' ' A' ' 22' ' ' SER . 16.8 t -69.61 -80.07 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.888 -0.597 . . . . 186.91999999999999 110.739 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 1.8 m 167.01 131.68 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.041 -0.527 . . . . 154.25 110.097 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.2 m -57.36 -28.69 63.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.202 -0.454 . . . . 331.81999999999999 110.929 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.16 -40.87 29.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.819 0.342 . . . . 124.91 111.135 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.435 ' OG1' ' O ' ' A' ' 22' ' ' SER . 14.3 p -57.6 -64.69 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.161 -0.472 . . . . 102.61 110.048 -179.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.5 p -54.48 -31.94 23.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.377 -0.374 . . . . 302.57999999999998 111.093 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.2 t -73.65 -36.7 65.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.342 -0.39 . . . . 260.91000000000003 111.071 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -82.2 -19.42 39.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.991 0.425 . . . . 999.99000000000001 110.365 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.29 -19.8 5.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.828 -0.624 . . . . 209.84 111.153 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.2 mt -88.09 -9.6 52.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.709 0.29 . . . . 799.29999999999995 110.862 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 7.5 mmt -115.99 -38.39 3.65 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.46 -0.336 . . . . 455.36000000000001 110.735 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -155.89 87.1 3.08 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 492.02999999999997 110.479 -179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.83 73.15 6.15 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 122.162 1.908 . . . . 277.31 112.075 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -155.05 26.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.955 -0.566 . . . . 999.99000000000001 110.426 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -111.89 -19.99 12.19 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.128 -0.487 . . . . 999.99000000000001 110.135 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.1 t -65.97 143.17 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.055 -0.52 . . . . 342.27999999999997 110.432 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.538 ' O ' ' N ' ' A' ' 41' ' ' ARG . 5.6 t -61.16 145.44 51.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 275.69 110.32 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -47.71 -52.23 19.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.164 -0.471 . . . . 913.66999999999996 110.966 -179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.87 -52.87 62.38 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.229 -0.589 . . . . 173.06 110.229 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 72.1 m -65.17 -22.36 66.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.16 -0.473 . . . . 166.53 110.896 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 37' ' ' SER . 63.0 ttt180 -71.23 -41.34 70.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 999.99000000000001 110.846 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -68.14 -32.02 72.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.897 0.379 . . . . 639.24000000000001 110.762 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.6 mtp180 -69.39 -46.01 67.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.099 -0.5 . . . . 739.13999999999999 109.983 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.68 -50.73 78.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.941 -0.572 . . . . 323.55000000000001 110.235 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -50.57 -50.53 53.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.254 -0.43 . . . . 357.44999999999999 110.829 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -70.21 -34.97 73.56 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.887 -0.325 . . . . 881.86000000000001 110.561 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.61 -22.08 61.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.438 . . . . 189.5 110.53 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.36 -46.37 88.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.442 . . . . 143.63999999999999 110.534 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -75.78 -34.58 60.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 999.99000000000001 110.881 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -59.49 -45.83 90.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.362 -0.381 . . . . 396.76999999999998 111.326 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.5 p -75.35 -16.7 15.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 C-N-CA 120.853 -0.339 . . . . 379.91000000000003 110.723 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.71 53.82 43.04 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 111.474 -0.65 . . . . 130.71000000000001 111.474 179.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -107.63 149.01 28.58 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.766 0.317 . . . . 858.00999999999999 110.259 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.3 mt -140.08 152.05 66.51 Favored Pre-proline 0 N--CA 1.466 0.344 0 CA-C-N 116.218 -0.446 . . . . 999.99000000000001 109.974 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo . . . . . 0 N--CA 1.495 1.559 0 C-N-CA 122.148 1.899 . . . . 999.99000000000001 111.891 179.944 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.417 ' HB3' HG13 ' A' ' 51' ' ' VAL . . . . . . . . 0 N--CA 1.462 0.161 0 CA-C-O 120.781 0.324 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.446 HG22 ' H ' ' A' ' 13' ' ' LYS . 24.8 m -143.55 148.69 36.33 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.361 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 10.5 ptt? -53.62 -27.26 26.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.708 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.446 ' H ' HG22 ' A' ' 11' ' ' THR . 32.4 ttmt -72.54 -41.88 65.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.662 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -63.07 -34.74 78.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.479 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.409 ' CG2' HG21 ' A' ' 51' ' ' VAL . 54.3 t -64.59 -37.44 80.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.589 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.55 -46.18 66.69 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.007 0.432 . . . . 0.0 110.006 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.4 mt -66.98 -39.35 87.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.306 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -65.02 -32.47 74.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.983 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.39 12.7 31.28 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.76 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt 35.46 47.9 0.38 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.319 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.429 ' O ' ' OG ' ' A' ' 22' ' ' SER . 11.4 t -69.03 -79.99 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.814 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 1.6 m 167.09 129.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.267 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.2 t -51.55 -29.7 17.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.972 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.55 -41.23 27.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.864 0.364 . . . . 0.0 111.227 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.41 ' OG1' HG12 ' A' ' 21' ' ' VAL . 15.8 p -57.68 -64.88 0.75 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.85 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.4 p -50.87 -34.68 13.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.721 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.9 t -76.63 -32.52 58.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.78 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 31' ' ' MET . 52.4 mmt-85 -82.45 -19.54 38.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.131 0.491 . . . . 0.0 110.103 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.79 -20.04 0.44 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.005 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 pp -102.61 -16.04 16.19 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.718 0.294 . . . . 0.0 110.484 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.409 ' N ' ' O ' ' A' ' 28' ' ' ARG . 41.6 mtt -100.28 -53.5 3.1 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.476 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -143.97 83.37 10.37 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.347 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -80.93 63.06 8.74 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.278 1.986 . . . . 0.0 112.039 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -154.85 34.69 0.4 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.433 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -124.32 -14.73 6.89 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.31 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 97.2 t -65.88 144.56 14.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.066 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.519 ' O ' ' N ' ' A' ' 41' ' ' ARG . 5.6 t -59.6 144.9 46.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.163 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -47.7 -53.85 13.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.637 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.06 -53.15 61.15 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.364 -0.534 . . . . 0.0 109.812 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 86.5 m -62.18 -24.7 67.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.836 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' A' ' 37' ' ' SER . 41.6 ttp180 -70.57 -42.84 70.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.673 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.0 t-20 -65.61 -33.67 76.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.729 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -68.71 -43.38 76.12 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.947 0.403 . . . . 0.0 110.254 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 47.4 t -58.37 -50.55 78.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.155 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -50.61 -50.08 54.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.613 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -70.24 -39.56 74.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.779 0.324 . . . . 0.0 110.672 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.7 -23.54 66.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.736 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.472 ' O ' ' N ' ' A' ' 52' ' ' GLY . . . -73.02 -38.35 66.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.782 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -68.27 -38.0 81.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.927 0.394 . . . . 0.0 110.362 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -59.4 -51.02 71.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.217 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.417 HG13 ' HB3' ' A' ' 10' ' ' ALA . 72.1 t -82.53 -24.45 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.698 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.472 ' N ' ' O ' ' A' ' 48' ' ' ALA . . . . . . . . 0 CA--C 1.527 0.835 0 N-CA-C 112.132 -0.387 . . . . 0.0 112.132 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.196 0 CA-C-O 120.862 0.363 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.4 m -143.66 148.96 36.55 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.226 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 11.5 tpt -48.26 -30.0 4.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.691 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -74.55 -42.01 59.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.693 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -62.0 -34.51 76.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.87 0.367 . . . . 0.0 110.588 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.5 t -62.03 -40.51 87.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.259 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.494 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.86 -41.77 64.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.409 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.6 tp -59.95 -42.86 94.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.322 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -63.89 -33.32 75.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.769 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.429 ' HB3' HG23 ' A' ' 21' ' ' VAL . . . -103.65 5.68 36.57 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.753 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 16' ' ' ALA . 65.9 mttm 41.41 46.98 3.04 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.078 0.466 . . . . 0.0 110.641 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.429 HG23 ' HB3' ' A' ' 19' ' ' ALA . 80.0 t -70.07 -81.87 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.137 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.431 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.5 t 171.36 129.74 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.335 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 35.6 m -62.92 -28.61 70.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.728 -179.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.65 -38.85 32.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.918 0.39 . . . . 0.0 111.253 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' A' ' 22' ' ' SER . 17.9 p -56.63 -64.48 0.86 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.838 -178.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.9 t -51.54 -25.52 5.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.2 p -77.15 -31.49 55.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.377 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' A' ' 32' ' ' ASN . 97.4 mtt180 -82.07 -19.48 40.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.217 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.46 -19.92 0.99 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.108 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.564 HD12 ' N ' ' A' ' 30' ' ' LEU . 9.7 mp -97.12 -12.28 23.32 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.564 0.221 . . . . 0.0 110.924 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 20.2 mmt -121.62 -52.08 2.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.803 0.335 . . . . 0.0 110.894 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 28' ' ' ARG . 9.6 t-20 -130.22 80.6 70.38 Favored Pre-proline 0 N--CA 1.466 0.339 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.382 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.99 61.61 7.88 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 C-N-CA 122.475 2.117 . . . . 0.0 112.298 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -161.68 44.53 0.16 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.622 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -127.18 -20.69 4.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.632 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.1 t -66.59 141.93 17.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.536 ' O ' ' N ' ' A' ' 41' ' ' ARG . 1.6 m -58.43 143.3 45.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.791 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -47.48 -53.87 13.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.739 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.49 -52.26 66.4 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.805 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.457 ' O ' HG23 ' A' ' 44' ' ' VAL . 95.5 m -64.68 -22.01 66.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.887 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.536 ' N ' ' O ' ' A' ' 37' ' ' SER . 16.9 tpt180 -71.01 -42.21 69.88 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.614 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -68.76 -36.32 78.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.864 0.364 . . . . 0.0 110.765 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 45.3 ttm-85 -68.11 -44.14 76.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.107 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.511 ' O ' ' N ' ' A' ' 48' ' ' ALA . 37.2 t -58.88 -48.89 84.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.911 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.6 tt0 -50.11 -50.82 47.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.61 -179.356 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -70.3 -35.53 73.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.85 0.357 . . . . 0.0 110.576 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.81 -23.61 60.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.409 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -68.01 -39.2 83.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.61 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -71.87 -34.51 69.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.331 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -53.84 -50.71 65.61 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.546 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.467 HG22 ' O ' ' A' ' 51' ' ' VAL . 7.4 p -79.43 -8.24 11.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.535 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.758 0 N-CA-C 111.647 -0.581 . . . . 0.0 111.647 179.109 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.169 0 CA-C-O 120.714 0.292 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 13' ' ' LYS . 28.0 m -146.33 149.56 34.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.367 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 63.3 mtt -50.89 -25.27 4.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.481 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.424 ' H ' HG22 ' A' ' 11' ' ' THR . 35.9 ttpt -75.57 -43.25 49.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.951 -179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -62.35 -33.95 75.7 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.636 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.413 HG11 ' HB1' ' A' ' 47' ' ' ALA . 77.8 t -65.15 -37.39 80.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.591 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.36 -45.2 65.65 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.7 tp -54.09 -41.5 68.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.32 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -69.9 -42.83 72.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.028 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.61 -0.38 37.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.153 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp 42.91 33.43 0.5 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.974 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.436 HG23 ' H ' ' A' ' 22' ' ' SER . 0.0 OUTLIER -70.35 -74.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.131 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.436 ' H ' HG23 ' A' ' 21' ' ' VAL . 2.0 t 172.35 139.37 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.352 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.8 m -67.66 -28.87 68.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.045 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.08 -38.31 44.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.977 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.0 p -57.62 -64.85 0.76 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.129 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.3 p -50.81 -27.67 5.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.191 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.3 p -82.75 -34.78 27.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.047 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.0 mtt-85 -81.81 -30.48 32.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.853 0.358 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.495 ' C ' ' H ' ' A' ' 31' ' ' MET . . . -53.97 -54.91 32.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.615 -179.51 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.7 mt -49.77 -10.25 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.843 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.495 ' H ' ' C ' ' A' ' 29' ' ' ALA . 15.6 mmt -115.33 -36.16 4.41 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.857 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' A' ' 34' ' ' ASP . 25.6 m120 -156.01 81.94 3.68 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.822 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -63.33 54.62 0.16 Allowed 'Trans proline' 0 N--CA 1.501 1.928 0 C-N-CA 122.97 2.447 . . . . 0.0 112.451 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' ASN . 19.6 t70 -122.94 -29.56 3.92 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.979 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -66.6 -23.55 66.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.755 0.312 . . . . 0.0 110.735 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.0 m -69.03 139.57 20.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.413 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.522 ' O ' ' N ' ' A' ' 41' ' ' ARG . 58.6 m -71.72 159.31 34.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.228 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -47.06 -58.61 3.83 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.224 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.83 -52.89 63.31 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.099 -0.64 . . . . 0.0 109.452 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.482 ' O ' HG23 ' A' ' 44' ' ' VAL . 53.4 m -58.52 -25.64 62.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.711 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 37' ' ' SER . 20.1 ttm180 -70.47 -39.32 74.31 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.874 0.369 . . . . 0.0 110.4 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -71.49 -45.55 62.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.942 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.6 ttm180 -63.43 -43.33 97.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.951 0.405 . . . . 0.0 110.067 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 40' ' ' THR . 25.1 t -60.18 -51.83 68.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.851 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -51.0 -44.76 60.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.849 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 55.5 mttm -70.07 -38.26 75.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.669 0.271 . . . . 0.0 110.713 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.421 ' O ' HG12 ' A' ' 51' ' ' VAL . . . -57.42 -22.61 44.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.75 -179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.09 -44.74 79.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.834 0.35 . . . . 0.0 110.468 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -76.44 -43.6 39.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.964 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 60.1 tt0 -59.57 -42.71 93.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.702 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.421 HG12 ' O ' ' A' ' 47' ' ' ALA . 6.3 p -75.6 -22.83 16.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.964 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.668 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.948 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.288 0 CA-C-O 120.872 0.368 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.3 p -57.79 155.52 10.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.365 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 70.4 mtp -48.86 -24.69 1.54 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.203 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.45 ' NZ ' ' CB ' ' A' ' 13' ' ' LYS . 8.5 mtmp? -72.44 -42.97 64.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.461 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -57.61 -38.37 74.82 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.821 0.343 . . . . 0.0 110.394 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.53 -47.05 89.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.408 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.58 -29.92 28.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.405 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -64.82 -48.08 75.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.055 179.977 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -71.3 -37.77 71.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.08 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.401 ' HB3' HG23 ' A' ' 21' ' ' VAL . . . -88.84 -1.8 58.27 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.864 0.364 . . . . 0.0 110.434 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.46 ' N ' ' O ' ' A' ' 16' ' ' ALA . 40.7 mtmt 43.32 47.25 5.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.705 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' A' ' 22' ' ' SER . 30.2 t -70.05 -79.54 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.662 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.442 ' OG ' ' CG2' ' A' ' 25' ' ' THR . 1.0 OUTLIER 165.78 134.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.111 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.6 m -60.88 -27.87 68.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.425 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.71 -40.93 39.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.836 0.35 . . . . 0.0 111.073 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.442 ' CG2' ' OG ' ' A' ' 22' ' ' SER . 12.3 p -58.33 -65.53 0.64 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.926 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.9 p -53.73 -33.91 23.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.997 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.8 t -75.02 -37.1 61.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.682 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.3 mmt85 -82.46 -20.43 36.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.287 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -70.96 -20.5 62.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.896 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.7 mt -61.61 -25.58 67.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.72 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 67.3 mtm -122.35 -14.59 7.84 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.852 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -151.69 82.23 5.65 Favored Pre-proline 0 N--CA 1.464 0.25 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.638 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -79.9 73.92 5.79 Favored 'Trans proline' 0 N--CA 1.492 1.427 0 C-N-CA 122.203 1.935 . . . . 0.0 112.123 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -160.6 28.99 0.16 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.52 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -106.6 -23.19 12.53 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.422 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.456 HG22 ' H ' ' A' ' 36' ' ' VAL . 2.6 m -65.75 145.59 13.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.943 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.566 ' O ' ' N ' ' A' ' 41' ' ' ARG . 16.1 t -64.22 153.66 37.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.141 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.558 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 3.1 mp0 -46.81 -56.43 6.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.851 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.39 -51.9 67.92 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 119.944 -0.703 . . . . 0.0 109.654 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.43 ' O ' HG13 ' A' ' 44' ' ' VAL . 97.2 m -63.06 -21.81 66.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.248 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.566 ' N ' ' O ' ' A' ' 37' ' ' SER . 32.9 ttp180 -71.45 -37.38 71.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.906 0.384 . . . . 0.0 110.967 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -74.56 -39.18 62.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.063 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -64.34 -48.1 76.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.024 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.48 HG23 ' N ' ' A' ' 45' ' ' GLU . 34.1 m -62.2 -45.13 99.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.042 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.48 ' N ' HG23 ' A' ' 44' ' ' VAL . 32.8 tt0 -51.04 -50.64 58.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.88 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.1 mmtp -71.62 -33.77 69.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.851 0.358 . . . . 0.0 111.108 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.32 -21.81 61.27 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.074 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.15 -37.86 72.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.803 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -72.65 -38.72 67.58 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.432 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -54.72 -45.78 74.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.742 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.3 m -75.78 -0.8 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.646 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.717 0 N-CA-C 111.174 -0.771 . . . . 0.0 111.174 179.909 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.422 0 CA-C-O 120.738 0.304 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.3 p -61.01 168.81 2.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.398 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.3 ttt -57.09 -24.81 56.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.279 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -68.4 -40.33 81.33 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.193 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -63.3 -36.98 85.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.49 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 92.9 t -58.27 -45.18 89.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.748 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.73 -40.24 62.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.989 0.423 . . . . 0.0 110.401 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.2 tp -56.55 -45.76 81.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.8 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -69.01 -33.94 74.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.293 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.14 -1.39 57.75 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.696 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 46.12 45.61 12.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.977 0.417 . . . . 0.0 110.64 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.41 ' O ' ' CB ' ' A' ' 22' ' ' SER . 21.6 t -69.61 -78.11 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.089 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.41 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.5 t 165.92 136.79 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.422 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.0 m -61.75 -28.07 69.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.067 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.86 -39.84 42.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.819 0.342 . . . . 0.0 111.067 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 22' ' ' SER . 19.9 p -57.66 -65.13 0.68 Allowed 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.791 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.9 p -52.3 -31.4 14.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.784 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.5 t -76.2 -36.13 58.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.724 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -79.36 -19.46 50.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.019 0.438 . . . . 0.0 110.276 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.01 -20.04 61.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.693 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 23.7 mt -63.25 -22.31 66.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.403 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 8.3 ptp -121.59 -13.1 8.42 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.581 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -152.24 68.6 7.28 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.505 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.66 161.56 19.12 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.895 2.396 . . . . 0.0 112.337 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 78.38 25.38 0.58 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.473 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -127.07 17.66 7.2 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.319 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 17.4 m -77.02 162.63 4.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.492 ' O ' ' N ' ' A' ' 41' ' ' ARG . 40.9 t -46.13 146.46 1.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.903 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.428 ' CG ' ' N ' ' A' ' 39' ' ' ALA . 14.7 pt20 -47.49 -44.95 25.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.604 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.428 ' N ' ' CG ' ' A' ' 38' ' ' GLN . . . -63.02 -52.93 60.98 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.446 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 85.2 m -64.44 -22.55 66.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.618 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 37' ' ' SER . 33.5 ttt85 -70.05 -44.9 68.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.032 0.444 . . . . 0.0 110.183 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -74.54 -43.67 54.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.875 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 63.1 mtp180 -65.8 -43.56 88.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.607 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.3 p -65.05 -41.24 91.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 119.842 -0.743 . . . . 0.0 110.327 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -51.26 -50.69 58.73 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.558 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -71.58 -35.48 70.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.838 0.352 . . . . 0.0 111.068 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.18 -21.21 65.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.21 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.03 -47.35 59.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.869 0.366 . . . . 0.0 110.494 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -74.0 -41.7 61.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.922 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -60.61 -50.51 73.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.851 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 51' ' ' VAL . 45.4 t -76.41 -6.45 8.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.026 0.441 . . . . 0.0 110.334 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.741 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.625 179.186 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.405 ' HB3' HG23 ' A' ' 51' ' ' VAL . . . . . . . . 0 N--CA 1.463 0.197 0 CA-C-O 120.797 0.332 . . . . 0.0 110.528 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 p -143.58 146.96 33.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.971 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.1 ptm -47.95 -26.25 1.67 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.917 0.389 . . . . 0.0 110.417 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -78.66 -47.26 17.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.568 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -57.61 -36.69 72.12 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 120.872 0.367 . . . . 0.0 110.555 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.6 t -58.42 -45.13 89.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.592 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.73 -41.2 63.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.753 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.7 mt -76.06 -45.27 35.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.588 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.55 -42.97 84.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.876 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.96 16.65 24.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.672 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.9 pttm 35.88 47.74 0.44 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.104 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.401 ' O ' ' CB ' ' A' ' 22' ' ' SER . 17.2 t -68.67 -78.01 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.593 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.401 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.4 t 168.58 138.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.496 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 26.1 m -68.29 -28.04 66.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.818 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.9 -43.8 24.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.837 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.441 ' O ' ' N ' ' A' ' 29' ' ' ALA . 53.0 p -58.21 -65.04 0.71 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.144 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p -50.95 -29.37 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.069 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.6 m -82.08 -36.94 27.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.751 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -82.78 -19.58 37.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.282 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.441 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -48.87 -53.63 18.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.597 -179.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.02 -10.02 57.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.073 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 41.1 mtp -94.17 -52.09 4.53 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.041 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -160.83 86.9 1.76 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.753 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -47.7 107.09 0.12 Allowed 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.404 2.069 . . . . 0.0 111.894 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.495 ' C ' ' H ' ' A' ' 36' ' ' VAL . 29.4 t70 -176.74 -31.22 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.569 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.2 mmmm -66.12 11.37 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.51 -178.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.495 ' H ' ' C ' ' A' ' 34' ' ' ASP . 3.5 m -107.38 127.93 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.541 ' O ' ' N ' ' A' ' 41' ' ' ARG . 39.6 t -72.42 164.59 26.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.534 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -47.6 -54.92 10.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.329 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.33 -53.35 59.27 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.575 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.454 ' O ' HG23 ' A' ' 44' ' ' VAL . 52.0 m -62.2 -23.26 66.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.045 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -71.26 -44.78 64.6 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.296 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -70.02 -42.68 72.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.12 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 71.3 mtp85 -65.36 -45.36 84.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 110.252 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 28.0 t -60.15 -48.13 89.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.054 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -51.14 -51.67 51.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.739 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -70.23 -39.94 74.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.798 0.333 . . . . 0.0 110.87 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.95 -23.05 61.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.889 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.58 -39.36 64.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.6 ttp180 -69.85 -35.26 74.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.027 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -55.88 -49.86 72.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.47 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.497 HG22 ' O ' ' A' ' 51' ' ' VAL . 7.9 p -75.42 -7.16 9.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.782 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.526 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 179.375 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.739 0.304 . . . . 0.0 110.431 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.0 p -140.65 145.45 36.61 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.159 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 22.4 ttt -59.87 -25.17 64.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.633 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -71.78 -46.73 57.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.208 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -61.93 -33.02 73.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.423 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 52.4 t -61.47 -45.98 97.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.612 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.54 -37.47 57.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.528 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -62.94 -46.35 88.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.022 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -66.54 -33.96 76.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.038 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.419 ' HB3' HG23 ' A' ' 21' ' ' VAL . . . -93.64 5.9 50.08 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.381 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.5 ttmt 41.2 45.35 2.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.993 0.425 . . . . 0.0 110.669 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.436 ' O ' ' CB ' ' A' ' 22' ' ' SER . 21.2 t -69.46 -78.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.795 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.6 m 165.87 136.69 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.139 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.6 p -64.65 -28.44 69.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.0 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.03 -40.99 29.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.058 0.456 . . . . 0.0 110.706 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.6 p -57.15 -64.25 0.94 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.165 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p -50.15 -27.02 3.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.825 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.7 m -80.13 -32.06 38.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -82.09 -19.37 40.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.179 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.17 -19.47 64.0 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.58 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.2 mt -86.63 -15.63 39.13 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.204 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.1 mmt -100.31 -32.2 10.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.416 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -160.18 147.42 12.5 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.435 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.53 -45.12 0.13 Allowed 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.257 1.971 . . . . 0.0 112.253 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -69.65 55.41 0.12 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.42 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -127.41 -5.8 5.92 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.902 0.382 . . . . 0.0 110.303 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.1 m -104.52 142.79 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.282 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.525 ' O ' ' N ' ' A' ' 41' ' ' ARG . 39.6 m -66.01 160.01 24.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.168 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.64 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -47.42 -48.49 26.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.41 -179.427 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.43 -53.16 56.64 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.221 -0.592 . . . . 0.0 109.643 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.7 m -62.3 -22.88 66.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.774 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.525 ' N ' ' O ' ' A' ' 37' ' ' SER . 56.9 ttt180 -71.46 -44.2 65.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.613 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -72.32 -42.78 65.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.465 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -65.12 -45.06 86.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.836 0.351 . . . . 0.0 110.591 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 25.4 t -60.79 -45.57 97.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.987 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -50.95 -52.52 41.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.68 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -71.69 -38.07 70.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.726 0.298 . . . . 0.0 111.071 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.61 -22.21 61.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.92 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.15 -42.8 62.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.447 ' CA ' ' HE ' ' A' ' 49' ' ' ARG . 0.0 OUTLIER -64.74 -34.78 79.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.313 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -53.49 -50.45 65.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.189 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.525 ' O ' HG12 ' A' ' 51' ' ' VAL . 61.4 t -90.95 -3.35 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.111 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.775 0 N-CA-C 111.624 -0.59 . . . . 0.0 111.624 179.451 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.157 0 CA-C-O 120.793 0.33 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.5 p -140.83 146.41 37.54 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.175 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.2 mtm -56.9 -24.86 55.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.6 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 53.2 mttm -71.88 -41.62 67.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.889 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -66.28 -37.51 85.61 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.046 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 74.9 t -67.25 -32.63 58.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.476 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.59 -46.53 66.97 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.548 -0.461 . . . . 0.0 109.813 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 mt -60.78 -33.04 72.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.984 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -63.39 -33.54 75.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.33 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.08 7.23 38.91 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.358 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.456 ' CB ' ' NZ ' ' A' ' 20' ' ' LYS . 7.8 mtpm? 42.97 49.12 5.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.615 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.0 t -72.49 -81.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.695 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.8 m 168.28 131.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.959 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.1 p -56.26 -28.88 60.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.0 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.63 -40.72 28.6 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.165 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.4 p -57.3 -64.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.177 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.3 p -50.55 -31.23 8.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.891 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.0 m -73.19 -29.62 62.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.854 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 32' ' ' ASN . 58.7 mtp85 -78.16 -19.31 54.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.95 0.405 . . . . 0.0 110.563 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.476 ' C ' HD12 ' A' ' 30' ' ' LEU . . . -48.58 -20.37 0.44 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.754 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.476 HD12 ' C ' ' A' ' 29' ' ' ALA . 9.1 mp -103.71 -26.17 12.86 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.37 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.406 ' O ' ' CG ' ' A' ' 32' ' ' ASN . 59.8 mmm -95.63 -56.76 2.58 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.479 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.409 ' N ' ' O ' ' A' ' 28' ' ' ARG . 3.5 m120 -178.71 93.82 0.22 Allowed Pre-proline 0 CA--C 1.54 0.585 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -81.56 86.42 1.59 Allowed 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.923 1.749 . . . . 0.0 112.113 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -113.21 -16.96 12.46 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.638 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.532 ' CD ' ' N ' ' A' ' 35' ' ' LYS . 9.6 mptt -82.84 -15.54 51.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.364 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 t -71.69 127.43 33.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.438 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.465 ' O ' ' N ' ' A' ' 41' ' ' ARG . 9.6 t -63.87 147.8 51.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.453 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.581 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 1.9 mp0 -47.19 -53.77 12.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.849 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.38 -52.67 64.26 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.877 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.0 m -60.49 -26.41 66.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.599 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 37' ' ' SER . 37.1 ttt85 -70.51 -39.07 74.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.728 -179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -66.04 -33.68 76.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.6 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 65.0 mtm180 -68.24 -40.43 82.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.211 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.98 -52.15 64.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.064 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -50.74 -43.63 58.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.572 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -69.95 -38.8 76.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.831 0.348 . . . . 0.0 110.702 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.415 ' O ' HG12 ' A' ' 51' ' ' VAL . . . -57.74 -22.06 44.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.68 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.79 -46.01 63.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.009 0.433 . . . . 0.0 110.567 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 46.1 mtp85 -76.47 -34.56 58.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.943 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -72.16 -39.31 68.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.649 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.415 HG12 ' O ' ' A' ' 47' ' ' ALA . 5.8 p -75.28 -23.68 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.995 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.751 0 N-CA-C 111.387 -0.685 . . . . 0.0 111.387 179.592 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.272 0 CA-C-O 120.806 0.336 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.462 HG22 ' H ' ' A' ' 13' ' ' LYS . 22.1 m -142.63 145.69 33.74 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.104 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 13.9 ptt? -54.49 -26.25 30.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.577 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.462 ' H ' HG22 ' A' ' 11' ' ' THR . 29.7 ttpt -71.23 -36.85 71.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.692 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -69.95 -34.5 73.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.963 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.1 t -64.88 -37.08 79.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.613 -0.435 . . . . 0.0 109.951 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.87 -45.68 67.55 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.1 tp -49.89 -38.44 35.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.949 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -68.12 -38.73 82.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.631 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.11 2.35 56.4 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.179 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.446 ' N ' ' O ' ' A' ' 16' ' ' ALA . 49.9 mttp 45.15 53.41 7.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.576 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 92.4 t -85.83 -83.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.806 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 2.9 m 174.84 134.02 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.118 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.3 p -69.0 -28.28 66.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.115 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.23 -39.11 41.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.847 0.356 . . . . 0.0 110.966 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.0 p -57.63 -64.8 0.77 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.078 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 28.1 t -59.56 -27.08 36.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.831 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.9 t -76.65 -39.96 50.61 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.864 -0.335 . . . . 0.0 110.626 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.3 mtt-85 -82.63 -26.75 31.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.935 0.398 . . . . 0.0 110.358 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.473 ' C ' ' H ' ' A' ' 31' ' ' MET . . . -48.43 -47.79 37.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.834 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -56.91 -5.25 0.22 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.253 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.473 ' H ' ' C ' ' A' ' 29' ' ' ALA . 41.0 mtt -121.96 -41.49 2.44 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.883 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -157.27 88.09 2.61 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.642 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -83.1 69.06 7.23 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 122.275 1.983 . . . . 0.0 112.077 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -119.1 -22.74 7.08 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.044 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -77.73 -24.45 49.09 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.746 0.307 . . . . 0.0 110.786 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.83 135.93 27.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.29 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.554 ' O ' ' N ' ' A' ' 41' ' ' ARG . 10.6 t -67.83 151.95 46.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.272 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.613 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 23.1 mp0 -47.68 -55.48 9.37 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.813 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.54 -52.68 64.13 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.533 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 44' ' ' VAL . 65.0 m -60.44 -24.58 65.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.933 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.554 ' N ' ' O ' ' A' ' 37' ' ' SER . 30.8 ttp180 -71.28 -35.51 71.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.71 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -74.69 -41.21 60.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.971 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 44.9 ttt85 -62.46 -47.71 82.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.135 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.474 HG23 ' N ' ' A' ' 45' ' ' GLU . 33.7 m -62.97 -45.07 99.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.18 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.474 ' N ' HG23 ' A' ' 44' ' ' VAL . 37.4 tt0 -50.56 -46.76 57.8 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.437 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -70.25 -34.96 73.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.807 0.337 . . . . 0.0 110.682 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.445 ' O ' HG12 ' A' ' 51' ' ' VAL . . . -58.59 -21.97 54.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.784 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.19 -41.57 66.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.876 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -75.32 -36.64 61.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.14 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -69.82 -42.08 74.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.163 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 47' ' ' ALA . 8.7 p -75.82 -21.11 15.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.787 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.742 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 179.928 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.229 0 CA-C-O 120.891 0.376 . . . . 0.0 110.389 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.413 ' OG1' ' OD2' ' A' ' 14' ' ' ASP . 8.5 p -63.81 153.28 37.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.52 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 25.0 ttt -51.98 -24.88 7.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.327 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.9 mttp -70.63 -44.02 68.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.232 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.413 ' OD2' ' OG1' ' A' ' 11' ' ' THR . 36.1 m-20 -56.45 -37.56 70.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.259 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.5 t -58.4 -48.36 85.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.104 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.9 -29.48 28.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.673 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.511 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -67.07 -50.55 61.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.495 -179.649 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -76.06 -48.23 21.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.094 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.59 -4.98 25.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.663 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.9 tttt 42.62 47.06 4.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.487 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.459 HG12 ' OG1' ' A' ' 25' ' ' THR . 19.2 t -69.14 -79.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.278 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.419 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.6 m 165.66 134.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.245 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.9 m -57.11 -28.54 62.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.629 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.94 -41.47 29.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.865 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.459 ' OG1' HG12 ' A' ' 21' ' ' VAL . 15.1 p -57.88 -65.15 0.69 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.847 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.4 p -51.37 -33.22 13.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.863 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.9 t -78.17 -35.49 48.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.017 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 -83.28 -20.17 34.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.085 0.469 . . . . 0.0 110.138 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.449 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -54.6 -19.56 6.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.394 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.541 HD12 ' N ' ' A' ' 30' ' ' LEU . 10.1 mp -88.55 -5.95 57.87 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.635 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 21.3 mmt -121.45 -39.5 2.66 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.844 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -153.95 81.18 4.77 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.634 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -81.55 76.59 4.3 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.379 2.052 . . . . 0.0 111.965 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -158.94 29.25 0.21 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.488 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -121.06 -6.9 9.47 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.608 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.4 t -65.99 133.42 30.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.272 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.542 ' O ' ' N ' ' A' ' 41' ' ' ARG . 1.8 m -50.36 140.35 13.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.319 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -46.92 -53.61 11.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.609 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.31 -52.1 65.79 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.442 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.463 ' O ' HG23 ' A' ' 44' ' ' VAL . 88.1 m -65.19 -22.02 66.84 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.762 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.542 ' N ' ' O ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -70.64 -45.61 64.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.953 0.406 . . . . 0.0 110.249 179.685 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -67.53 -35.87 79.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.917 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.8 mtm180 -68.32 -34.89 76.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.584 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 24.8 t -67.46 -45.95 84.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -51.09 -55.63 16.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.147 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -71.38 -37.61 71.58 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.328 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.38 -22.03 61.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.1 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -72.84 -43.32 62.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.727 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -67.34 -34.62 77.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.575 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -60.07 -48.93 79.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.631 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.7 m -75.73 -8.87 12.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.587 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.668 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.986 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.289 0 CA-C-O 120.771 0.32 . . . . 150.80000000000001 110.343 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.408 ' OG1' ' OD2' ' A' ' 14' ' ' ASP . 7.7 p -145.67 153.4 40.97 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.258 -0.428 . . . . 140.56999999999999 110.053 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 3.2 mtp -52.48 -26.28 12.48 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.679 -0.489 . . . . 647.38 109.679 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.7 ttmt -71.64 -40.41 69.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.08 -0.509 . . . . 414.97000000000003 110.568 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.408 ' OD2' ' OG1' ' A' ' 11' ' ' THR . 54.2 m-20 -64.41 -33.76 76.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.324 -0.398 . . . . 336.18000000000001 110.471 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.4 t -64.15 -40.03 87.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 51.060000000000002 110.562 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.42 -42.4 64.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.981 0.42 . . . . 20.120000000000001 109.952 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.546 HD23 ' O ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -58.16 -40.24 80.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.842 -0.617 . . . . 224.53 109.672 179.647 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -67.63 -36.28 80.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 621.42999999999995 110.873 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.18 5.4 50.21 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.929 0.395 . . . . 30.77 110.207 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 16' ' ' ALA . 82.0 mttt 41.66 47.01 3.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.942 -0.572 . . . . 567.58000000000004 110.73 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.425 ' O ' ' OG ' ' A' ' 22' ' ' SER . 16.8 t -69.61 -80.07 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.888 -0.597 . . . . 66.439999999999998 110.739 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.425 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 1.8 m 167.01 131.68 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.041 -0.527 . . . . 124.63 110.097 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.2 m -57.36 -28.69 63.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.202 -0.454 . . . . 161.56999999999999 110.929 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.16 -40.87 29.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.819 0.342 . . . . 33.359999999999999 111.135 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.3 p -57.6 -64.69 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.161 -0.472 . . . . 27.440000000000001 110.048 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.5 p -54.48 -31.94 23.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.377 -0.374 . . . . 159.62 111.093 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.2 t -73.65 -36.7 65.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.342 -0.39 . . . . 155.36000000000001 111.071 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -82.2 -19.42 39.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.991 0.425 . . . . 775.5 110.365 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.29 -19.8 5.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.828 -0.624 . . . . 85.129999999999995 111.153 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.2 mt -88.09 -9.6 52.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.709 0.29 . . . . 569.50999999999999 110.862 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 7.5 mmt -115.99 -38.39 3.65 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.46 -0.336 . . . . 306.42000000000002 110.735 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -155.89 87.1 3.08 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 364.5 110.479 -179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.83 73.15 6.15 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 122.162 1.908 . . . . 203.0 112.075 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -155.05 26.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.955 -0.566 . . . . 999.99000000000001 110.426 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -111.89 -19.99 12.19 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.128 -0.487 . . . . 999.99000000000001 110.135 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.1 t -65.97 143.17 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.055 -0.52 . . . . 152.69999999999999 110.432 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.538 ' O ' ' N ' ' A' ' 41' ' ' ARG . 5.6 t -61.16 145.44 51.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 183.09999999999999 110.32 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -47.71 -52.23 19.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.164 -0.471 . . . . 606.50999999999999 110.966 -179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.87 -52.87 62.38 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.229 -0.589 . . . . 41.5 110.229 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 72.1 m -65.17 -22.36 66.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.16 -0.473 . . . . 57.18 110.896 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 37' ' ' SER . 63.0 ttt180 -71.23 -41.34 70.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 885.63999999999999 110.846 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -68.14 -32.02 72.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.897 0.379 . . . . 378.75 110.762 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.6 mtp180 -69.39 -46.01 67.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.099 -0.5 . . . . 499.13999999999999 109.983 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.68 -50.73 78.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.941 -0.572 . . . . 164.41999999999999 110.235 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -50.57 -50.53 53.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.254 -0.43 . . . . 357.44999999999999 110.829 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -70.21 -34.97 73.56 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.887 -0.325 . . . . 678.14999999999998 110.561 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.61 -22.08 61.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.438 . . . . 54.049999999999997 110.53 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.36 -46.37 88.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.442 . . . . 40.590000000000003 110.534 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -75.78 -34.58 60.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 999.99000000000001 110.881 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -59.49 -45.83 90.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.362 -0.381 . . . . 396.76999999999998 111.326 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.5 p -75.35 -16.7 15.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 C-N-CA 120.853 -0.339 . . . . 199.31 110.723 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.685 0 N-CA-C 111.474 -0.65 . . . . 130.71000000000001 111.474 179.443 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.417 ' HB3' HG13 ' A' ' 51' ' ' VAL . . . -83.72 178.83 7.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.471 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.446 HG22 ' H ' ' A' ' 13' ' ' LYS . 24.8 m -143.55 148.69 36.33 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.361 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 10.5 ptt? -53.62 -27.26 26.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.708 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.446 ' H ' HG22 ' A' ' 11' ' ' THR . 32.4 ttmt -72.54 -41.88 65.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.662 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -63.07 -34.74 78.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.479 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.409 ' CG2' HG21 ' A' ' 51' ' ' VAL . 54.3 t -64.59 -37.44 80.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.589 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.55 -46.18 66.69 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.007 0.432 . . . . 0.0 110.006 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.4 mt -66.98 -39.35 87.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.306 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -65.02 -32.47 74.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.983 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.39 12.7 31.28 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.76 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt 35.46 47.9 0.38 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.319 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.429 ' O ' ' OG ' ' A' ' 22' ' ' SER . 11.4 t -69.03 -79.99 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.814 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 1.6 m 167.09 129.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.267 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.2 t -51.55 -29.7 17.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.972 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.55 -41.23 27.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.864 0.364 . . . . 0.0 111.227 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.41 ' OG1' HG12 ' A' ' 21' ' ' VAL . 15.8 p -57.68 -64.88 0.75 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.85 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.4 p -50.87 -34.68 13.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.721 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.9 t -76.63 -32.52 58.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.78 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 31' ' ' MET . 52.4 mmt-85 -82.45 -19.54 38.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.131 0.491 . . . . 0.0 110.103 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.79 -20.04 0.44 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.005 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 pp -102.61 -16.04 16.19 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.718 0.294 . . . . 0.0 110.484 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.409 ' N ' ' O ' ' A' ' 28' ' ' ARG . 41.6 mtt -100.28 -53.5 3.1 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.476 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -143.97 83.37 10.37 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.347 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -80.93 63.06 8.74 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.278 1.986 . . . . 0.0 112.039 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -154.85 34.69 0.4 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.433 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -124.32 -14.73 6.89 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.31 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 97.2 t -65.88 144.56 14.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.066 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.519 ' O ' ' N ' ' A' ' 41' ' ' ARG . 5.6 t -59.6 144.9 46.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.163 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -47.7 -53.85 13.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.637 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.06 -53.15 61.15 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.364 -0.534 . . . . 0.0 109.812 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 86.5 m -62.18 -24.7 67.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.836 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' A' ' 37' ' ' SER . 41.6 ttp180 -70.57 -42.84 70.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.673 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.0 t-20 -65.61 -33.67 76.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.729 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -68.71 -43.38 76.12 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.947 0.403 . . . . 0.0 110.254 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 47.4 t -58.37 -50.55 78.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.155 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -50.61 -50.08 54.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.613 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -70.24 -39.56 74.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.779 0.324 . . . . 0.0 110.672 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.7 -23.54 66.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.736 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.472 ' O ' ' N ' ' A' ' 52' ' ' GLY . . . -73.02 -38.35 66.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.782 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -68.27 -38.0 81.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.927 0.394 . . . . 0.0 110.362 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -59.4 -51.02 71.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.217 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.417 HG13 ' HB3' ' A' ' 10' ' ' ALA . 72.1 t -82.53 -24.45 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.698 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.472 ' N ' ' O ' ' A' ' 48' ' ' ALA . . . 42.35 38.45 2.82 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 112.132 -0.387 . . . . 0.0 112.132 179.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -140.73 114.71 9.08 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.898 0.349 . . . . 0.0 110.087 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.41 65.6 3.97 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.423 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo . . . . . 0 C--N 1.308 -1.582 0 C-N-CA 122.662 2.241 . . . . 0.0 112.142 179.955 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -100.06 168.01 10.11 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.313 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.4 m -143.66 148.96 36.55 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.226 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 11.5 tpt -48.26 -30.0 4.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.691 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -74.55 -42.01 59.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.693 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -62.0 -34.51 76.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.87 0.367 . . . . 0.0 110.588 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.5 t -62.03 -40.51 87.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.259 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.494 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.86 -41.77 64.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.409 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.6 tp -59.95 -42.86 94.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.322 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -63.89 -33.32 75.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.769 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.429 ' HB3' HG23 ' A' ' 21' ' ' VAL . . . -103.65 5.68 36.57 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.753 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 16' ' ' ALA . 65.9 mttm 41.41 46.98 3.04 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.078 0.466 . . . . 0.0 110.641 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.429 HG23 ' HB3' ' A' ' 19' ' ' ALA . 80.0 t -70.07 -81.87 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.137 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.431 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.5 t 171.36 129.74 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.335 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 35.6 m -62.92 -28.61 70.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.728 -179.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.65 -38.85 32.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.918 0.39 . . . . 0.0 111.253 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' A' ' 22' ' ' SER . 17.9 p -56.63 -64.48 0.86 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.838 -178.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.9 t -51.54 -25.52 5.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.2 p -77.15 -31.49 55.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.377 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' A' ' 32' ' ' ASN . 97.4 mtt180 -82.07 -19.48 40.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.217 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.46 -19.92 0.99 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.108 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.564 HD12 ' N ' ' A' ' 30' ' ' LEU . 9.7 mp -97.12 -12.28 23.32 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.564 0.221 . . . . 0.0 110.924 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 20.2 mmt -121.62 -52.08 2.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.803 0.335 . . . . 0.0 110.894 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 28' ' ' ARG . 9.6 t-20 -130.22 80.6 70.38 Favored Pre-proline 0 N--CA 1.466 0.339 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.382 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.99 61.61 7.88 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 C-N-CA 122.475 2.117 . . . . 0.0 112.298 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -161.68 44.53 0.16 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.622 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -127.18 -20.69 4.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.632 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.1 t -66.59 141.93 17.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.536 ' O ' ' N ' ' A' ' 41' ' ' ARG . 1.6 m -58.43 143.3 45.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.791 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -47.48 -53.87 13.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.739 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.49 -52.26 66.4 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.805 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.457 ' O ' HG23 ' A' ' 44' ' ' VAL . 95.5 m -64.68 -22.01 66.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.887 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.536 ' N ' ' O ' ' A' ' 37' ' ' SER . 16.9 tpt180 -71.01 -42.21 69.88 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.614 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -68.76 -36.32 78.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.864 0.364 . . . . 0.0 110.765 -179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 45.3 ttm-85 -68.11 -44.14 76.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.107 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.511 ' O ' ' N ' ' A' ' 48' ' ' ALA . 37.2 t -58.88 -48.89 84.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.911 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.6 tt0 -50.11 -50.82 47.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.61 -179.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -70.3 -35.53 73.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.85 0.357 . . . . 0.0 110.576 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.81 -23.61 60.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.409 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -68.01 -39.2 83.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.61 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -71.87 -34.51 69.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.331 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -53.84 -50.71 65.61 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.546 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.538 HG13 ' H ' ' A' ' 53' ' ' TYR . 7.4 p -79.43 -8.24 11.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.535 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 52.37 28.61 28.34 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 111.647 -0.581 . . . . 0.0 111.647 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.538 ' H ' HG13 ' A' ' 51' ' ' VAL . 12.9 t80 -140.77 114.4 8.84 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.472 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.6 OUTLIER -156.91 50.57 0.45 Allowed Pre-proline 0 C--N 1.332 -0.19 0 CA-C-O 120.793 0.33 . . . . 0.0 111.114 -179.776 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.472 ' CD ' ' N ' ' A' ' 54' ' ' LEU . 55.5 Cg_endo . . . . . 0 C--N 1.306 -1.66 0 C-N-CA 122.588 2.192 . . . . 0.0 111.829 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -90.03 179.72 5.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.464 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 13' ' ' LYS . 28.0 m -146.33 149.56 34.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.367 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 63.3 mtt -50.89 -25.27 4.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.481 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.424 ' H ' HG22 ' A' ' 11' ' ' THR . 35.9 ttpt -75.57 -43.25 49.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.951 -179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -62.35 -33.95 75.7 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.636 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.413 HG11 ' HB1' ' A' ' 47' ' ' ALA . 77.8 t -65.15 -37.39 80.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.591 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.36 -45.2 65.65 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.7 tp -54.09 -41.5 68.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.32 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -69.9 -42.83 72.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.028 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.61 -0.38 37.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.153 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp 42.91 33.43 0.5 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.974 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.436 HG23 ' H ' ' A' ' 22' ' ' SER . 0.0 OUTLIER -70.35 -74.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.131 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.436 ' H ' HG23 ' A' ' 21' ' ' VAL . 2.0 t 172.35 139.37 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.352 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.8 m -67.66 -28.87 68.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.045 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.08 -38.31 44.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.977 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.0 p -57.62 -64.85 0.76 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.129 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.3 p -50.81 -27.67 5.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.191 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.3 p -82.75 -34.78 27.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.047 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.0 mtt-85 -81.81 -30.48 32.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.853 0.358 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.495 ' C ' ' H ' ' A' ' 31' ' ' MET . . . -53.97 -54.91 32.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.615 -179.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.7 mt -49.77 -10.25 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.843 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.495 ' H ' ' C ' ' A' ' 29' ' ' ALA . 15.6 mmt -115.33 -36.16 4.41 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.857 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' A' ' 34' ' ' ASP . 25.6 m120 -156.01 81.94 3.68 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.822 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -63.33 54.62 0.16 Allowed 'Trans proline' 0 N--CA 1.501 1.928 0 C-N-CA 122.97 2.447 . . . . 0.0 112.451 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' ASN . 19.6 t70 -122.94 -29.56 3.92 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.979 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -66.6 -23.55 66.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.755 0.312 . . . . 0.0 110.735 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.0 m -69.03 139.57 20.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.413 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.522 ' O ' ' N ' ' A' ' 41' ' ' ARG . 58.6 m -71.72 159.31 34.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.228 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -47.06 -58.61 3.83 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.224 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.83 -52.89 63.31 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.099 -0.64 . . . . 0.0 109.452 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.482 ' O ' HG23 ' A' ' 44' ' ' VAL . 53.4 m -58.52 -25.64 62.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.711 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 37' ' ' SER . 20.1 ttm180 -70.47 -39.32 74.31 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.874 0.369 . . . . 0.0 110.4 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -71.49 -45.55 62.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.942 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.6 ttm180 -63.43 -43.33 97.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.951 0.405 . . . . 0.0 110.067 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 40' ' ' THR . 25.1 t -60.18 -51.83 68.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.851 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -51.0 -44.76 60.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.849 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 55.5 mttm -70.07 -38.26 75.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.669 0.271 . . . . 0.0 110.713 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.421 ' O ' HG12 ' A' ' 51' ' ' VAL . . . -57.42 -22.61 44.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.75 -179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.09 -44.74 79.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.834 0.35 . . . . 0.0 110.468 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -76.44 -43.6 39.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.964 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 60.1 tt0 -59.57 -42.71 93.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.702 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.421 HG12 ' O ' ' A' ' 47' ' ' ALA . 6.3 p -75.6 -22.83 16.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.964 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 48.44 56.97 8.71 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -79.52 115.79 19.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.973 0.416 . . . . 0.0 110.231 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.702 ' H ' ' CD ' ' A' ' 55' ' ' PRO . 11.6 mt -115.57 -34.89 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.431 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.605 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.702 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 53.1 Cg_exo . . . . . 0 N--CA 1.496 1.652 0 C-N-CA 121.888 1.725 . . . . 0.0 112.122 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -104.34 83.73 2.1 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.405 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.3 p -57.79 155.52 10.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.365 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.506 ' SD ' ' CD2' ' A' ' 53' ' ' TYR . 70.4 mtp -48.86 -24.69 1.54 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.203 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.45 ' NZ ' ' CB ' ' A' ' 13' ' ' LYS . 8.5 mtmp? -72.44 -42.97 64.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.461 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -57.61 -38.37 74.82 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.821 0.343 . . . . 0.0 110.394 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.53 -47.05 89.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.408 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.58 -29.92 28.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.405 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -64.82 -48.08 75.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.055 179.977 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -71.3 -37.77 71.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.08 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.401 ' HB3' HG23 ' A' ' 21' ' ' VAL . . . -88.84 -1.8 58.27 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.864 0.364 . . . . 0.0 110.434 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.46 ' N ' ' O ' ' A' ' 16' ' ' ALA . 40.7 mtmt 43.32 47.25 5.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.705 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' A' ' 22' ' ' SER . 30.2 t -70.05 -79.54 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.662 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.442 ' OG ' ' CG2' ' A' ' 25' ' ' THR . 1.0 OUTLIER 165.78 134.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.111 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.6 m -60.88 -27.87 68.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.425 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.71 -40.93 39.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.836 0.35 . . . . 0.0 111.073 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.442 ' CG2' ' OG ' ' A' ' 22' ' ' SER . 12.3 p -58.33 -65.53 0.64 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.926 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.9 p -53.73 -33.91 23.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.997 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.8 t -75.02 -37.1 61.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.682 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.3 mmt85 -82.46 -20.43 36.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.287 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -70.96 -20.5 62.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.896 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.7 mt -61.61 -25.58 67.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.72 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 67.3 mtm -122.35 -14.59 7.84 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.852 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -151.69 82.23 5.65 Favored Pre-proline 0 N--CA 1.464 0.25 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.638 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -79.9 73.92 5.79 Favored 'Trans proline' 0 N--CA 1.492 1.427 0 C-N-CA 122.203 1.935 . . . . 0.0 112.123 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -160.6 28.99 0.16 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.52 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -106.6 -23.19 12.53 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.422 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.456 HG22 ' H ' ' A' ' 36' ' ' VAL . 2.6 m -65.75 145.59 13.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.943 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.566 ' O ' ' N ' ' A' ' 41' ' ' ARG . 16.1 t -64.22 153.66 37.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.141 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.558 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 3.1 mp0 -46.81 -56.43 6.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.851 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.39 -51.9 67.92 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 119.944 -0.703 . . . . 0.0 109.654 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.43 ' O ' HG13 ' A' ' 44' ' ' VAL . 97.2 m -63.06 -21.81 66.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.248 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.566 ' N ' ' O ' ' A' ' 37' ' ' SER . 32.9 ttp180 -71.45 -37.38 71.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.906 0.384 . . . . 0.0 110.967 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -74.56 -39.18 62.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.063 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -64.34 -48.1 76.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.024 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.48 HG23 ' N ' ' A' ' 45' ' ' GLU . 34.1 m -62.2 -45.13 99.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.042 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.48 ' N ' HG23 ' A' ' 44' ' ' VAL . 32.8 tt0 -51.04 -50.64 58.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.88 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.1 mmtp -71.62 -33.77 69.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.851 0.358 . . . . 0.0 111.108 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.32 -21.81 61.27 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.074 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.15 -37.86 72.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.803 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -72.65 -38.72 67.58 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.432 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -54.72 -45.78 74.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.742 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.3 m -75.78 -0.8 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.646 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 45.0 52.03 8.18 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.174 -0.771 . . . . 0.0 111.174 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.506 ' CD2' ' SD ' ' A' ' 12' ' ' MET . 77.5 t80 -82.29 129.67 34.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.764 0.316 . . . . 0.0 110.409 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.2 mt -132.31 151.53 78.48 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.013 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo . . . . . 0 N--CA 1.494 1.533 0 C-N-CA 122.171 1.914 . . . . 0.0 111.868 179.935 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -115.77 82.93 1.85 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.335 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.3 p -61.01 168.81 2.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.398 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.3 ttt -57.09 -24.81 56.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.279 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -68.4 -40.33 81.33 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.193 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -63.3 -36.98 85.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.49 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 92.9 t -58.27 -45.18 89.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.748 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.73 -40.24 62.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.989 0.423 . . . . 0.0 110.401 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.2 tp -56.55 -45.76 81.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.8 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -69.01 -33.94 74.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.293 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.14 -1.39 57.75 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.696 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 46.12 45.61 12.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.977 0.417 . . . . 0.0 110.64 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.41 ' O ' ' CB ' ' A' ' 22' ' ' SER . 21.6 t -69.61 -78.11 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.089 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.41 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.5 t 165.92 136.79 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.422 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.0 m -61.75 -28.07 69.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.067 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.86 -39.84 42.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.819 0.342 . . . . 0.0 111.067 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 22' ' ' SER . 19.9 p -57.66 -65.13 0.68 Allowed 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.791 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.9 p -52.3 -31.4 14.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.784 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.5 t -76.2 -36.13 58.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.724 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -79.36 -19.46 50.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.019 0.438 . . . . 0.0 110.276 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.01 -20.04 61.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.693 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 23.7 mt -63.25 -22.31 66.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.403 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 8.3 ptp -121.59 -13.1 8.42 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.581 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -152.24 68.6 7.28 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.505 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.66 161.56 19.12 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.895 2.396 . . . . 0.0 112.337 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 78.38 25.38 0.58 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.473 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -127.07 17.66 7.2 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.319 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 17.4 m -77.02 162.63 4.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.492 ' O ' ' N ' ' A' ' 41' ' ' ARG . 40.9 t -46.13 146.46 1.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.903 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.428 ' CG ' ' N ' ' A' ' 39' ' ' ALA . 14.7 pt20 -47.49 -44.95 25.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.604 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.428 ' N ' ' CG ' ' A' ' 38' ' ' GLN . . . -63.02 -52.93 60.98 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.446 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 85.2 m -64.44 -22.55 66.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.618 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 37' ' ' SER . 33.5 ttt85 -70.05 -44.9 68.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.032 0.444 . . . . 0.0 110.183 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -74.54 -43.67 54.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.875 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 63.1 mtp180 -65.8 -43.56 88.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.607 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.3 p -65.05 -41.24 91.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 119.842 -0.743 . . . . 0.0 110.327 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -51.26 -50.69 58.73 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.558 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -71.58 -35.48 70.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.838 0.352 . . . . 0.0 111.068 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.18 -21.21 65.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.21 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.03 -47.35 59.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.869 0.366 . . . . 0.0 110.494 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -74.0 -41.7 61.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.922 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -60.61 -50.51 73.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.851 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 51' ' ' VAL . 45.4 t -76.41 -6.45 8.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.026 0.441 . . . . 0.0 110.334 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.77 52.87 50.39 Favored Glycine 0 CA--C 1.526 0.741 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.625 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -93.32 130.39 39.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.777 0.322 . . . . 0.0 110.328 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.7 mt -131.5 152.22 80.09 Favored Pre-proline 0 N--CA 1.467 0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.831 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo . . . . . 0 N--CA 1.496 1.652 0 C-N-CA 122.148 1.899 . . . . 0.0 111.845 179.841 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.405 ' HB3' HG23 ' A' ' 51' ' ' VAL . . . -84.41 157.83 21.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.528 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 p -143.58 146.96 33.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.971 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.1 ptm -47.95 -26.25 1.67 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.917 0.389 . . . . 0.0 110.417 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -78.66 -47.26 17.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.568 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -57.61 -36.69 72.12 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 120.872 0.367 . . . . 0.0 110.555 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.6 t -58.42 -45.13 89.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.592 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.73 -41.2 63.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.753 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.7 mt -76.06 -45.27 35.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.588 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.55 -42.97 84.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.876 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.96 16.65 24.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.672 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.9 pttm 35.88 47.74 0.44 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.104 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.401 ' O ' ' CB ' ' A' ' 22' ' ' SER . 17.2 t -68.67 -78.01 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.593 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.401 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.4 t 168.58 138.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.496 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 26.1 m -68.29 -28.04 66.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.818 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.9 -43.8 24.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.837 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.441 ' O ' ' N ' ' A' ' 29' ' ' ALA . 53.0 p -58.21 -65.04 0.71 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.144 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p -50.95 -29.37 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.069 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.6 m -82.08 -36.94 27.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.751 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -82.78 -19.58 37.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.282 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.441 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -48.87 -53.63 18.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.597 -179.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.02 -10.02 57.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.073 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 41.1 mtp -94.17 -52.09 4.53 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.041 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -160.83 86.9 1.76 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.753 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -47.7 107.09 0.12 Allowed 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.404 2.069 . . . . 0.0 111.894 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.495 ' C ' ' H ' ' A' ' 36' ' ' VAL . 29.4 t70 -176.74 -31.22 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.569 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.2 mmmm -66.12 11.37 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.51 -178.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.495 ' H ' ' C ' ' A' ' 34' ' ' ASP . 3.5 m -107.38 127.93 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.541 ' O ' ' N ' ' A' ' 41' ' ' ARG . 39.6 t -72.42 164.59 26.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.534 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -47.6 -54.92 10.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.329 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.33 -53.35 59.27 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.575 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.454 ' O ' HG23 ' A' ' 44' ' ' VAL . 52.0 m -62.2 -23.26 66.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.045 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -71.26 -44.78 64.6 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.296 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -70.02 -42.68 72.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.12 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 71.3 mtp85 -65.36 -45.36 84.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 110.252 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 28.0 t -60.15 -48.13 89.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.054 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -51.14 -51.67 51.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.739 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -70.23 -39.94 74.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.798 0.333 . . . . 0.0 110.87 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.95 -23.05 61.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.889 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.58 -39.36 64.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.6 ttp180 -69.85 -35.26 74.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.027 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -55.88 -49.86 72.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.47 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.497 HG22 ' O ' ' A' ' 51' ' ' VAL . 7.9 p -75.42 -7.16 9.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.782 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.77 -31.19 2.24 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -80.65 114.79 19.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.8 mt -103.57 148.6 36.0 Favored Pre-proline 0 CA--C 1.533 0.322 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo . . . . . 0 N--CA 1.494 1.51 0 C-N-CA 121.977 1.785 . . . . 0.0 111.955 179.92 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.06 174.29 11.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.431 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.0 p -140.65 145.45 36.61 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.159 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 22.4 ttt -59.87 -25.17 64.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.633 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -71.78 -46.73 57.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.208 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -61.93 -33.02 73.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.423 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 52.4 t -61.47 -45.98 97.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.612 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.54 -37.47 57.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.528 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.517 HD23 ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -62.94 -46.35 88.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.022 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -66.54 -33.96 76.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.038 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.419 ' HB3' HG23 ' A' ' 21' ' ' VAL . . . -93.64 5.9 50.08 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.381 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.5 ttmt 41.2 45.35 2.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.993 0.425 . . . . 0.0 110.669 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.436 ' O ' ' CB ' ' A' ' 22' ' ' SER . 21.2 t -69.46 -78.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.795 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.6 m 165.87 136.69 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.139 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.6 p -64.65 -28.44 69.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.0 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.03 -40.99 29.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.058 0.456 . . . . 0.0 110.706 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.6 p -57.15 -64.25 0.94 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.165 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p -50.15 -27.02 3.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.825 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.7 m -80.13 -32.06 38.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -82.09 -19.37 40.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.179 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.17 -19.47 64.0 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.58 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.2 mt -86.63 -15.63 39.13 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.204 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.1 mmt -100.31 -32.2 10.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.416 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -160.18 147.42 12.5 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.435 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.53 -45.12 0.13 Allowed 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.257 1.971 . . . . 0.0 112.253 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -69.65 55.41 0.12 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.42 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -127.41 -5.8 5.92 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.902 0.382 . . . . 0.0 110.303 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.1 m -104.52 142.79 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.282 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.525 ' O ' ' N ' ' A' ' 41' ' ' ARG . 39.6 m -66.01 160.01 24.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.168 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.64 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -47.42 -48.49 26.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.41 -179.427 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.43 -53.16 56.64 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.221 -0.592 . . . . 0.0 109.643 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.7 m -62.3 -22.88 66.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.774 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.525 ' N ' ' O ' ' A' ' 37' ' ' SER . 56.9 ttt180 -71.46 -44.2 65.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.613 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -72.32 -42.78 65.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.465 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -65.12 -45.06 86.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.836 0.351 . . . . 0.0 110.591 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 25.4 t -60.79 -45.57 97.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.987 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -50.95 -52.52 41.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.68 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -71.69 -38.07 70.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.726 0.298 . . . . 0.0 111.071 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.61 -22.21 61.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.92 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.15 -42.8 62.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.447 ' CA ' ' HE ' ' A' ' 49' ' ' ARG . 0.0 OUTLIER -64.74 -34.78 79.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.313 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -53.49 -50.45 65.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.189 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.525 ' O ' HG12 ' A' ' 51' ' ' VAL . 61.4 t -90.95 -3.35 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.111 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 44.67 40.29 6.45 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 111.624 -0.59 . . . . 0.0 111.624 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -140.26 115.49 9.87 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.675 0.274 . . . . 0.0 110.669 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.617 ' H ' ' CD ' ' A' ' 55' ' ' PRO . 5.5 mt -108.68 -34.74 0.16 Allowed Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.178 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.617 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 52.1 Cg_exo . . . . . 0 N--CA 1.496 1.654 0 C-N-CA 121.877 1.718 . . . . 0.0 112.032 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -87.34 173.49 9.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.499 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.5 p -140.83 146.41 37.54 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.175 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.592 ' SD ' ' CD2' ' A' ' 53' ' ' TYR . 27.2 mtm -56.9 -24.86 55.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.6 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 53.2 mttm -71.88 -41.62 67.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.889 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -66.28 -37.51 85.61 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.046 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 74.9 t -67.25 -32.63 58.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.476 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.59 -46.53 66.97 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.548 -0.461 . . . . 0.0 109.813 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 mt -60.78 -33.04 72.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.984 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -63.39 -33.54 75.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.33 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.08 7.23 38.91 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.358 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.456 ' CB ' ' NZ ' ' A' ' 20' ' ' LYS . 7.8 mtpm? 42.97 49.12 5.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.615 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.0 t -72.49 -81.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.695 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.8 m 168.28 131.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.959 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.1 p -56.26 -28.88 60.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.0 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.63 -40.72 28.6 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.165 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.4 p -57.3 -64.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.177 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.3 p -50.55 -31.23 8.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.891 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.0 m -73.19 -29.62 62.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.854 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 32' ' ' ASN . 58.7 mtp85 -78.16 -19.31 54.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.95 0.405 . . . . 0.0 110.563 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.476 ' C ' HD12 ' A' ' 30' ' ' LEU . . . -48.58 -20.37 0.44 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.754 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.476 HD12 ' C ' ' A' ' 29' ' ' ALA . 9.1 mp -103.71 -26.17 12.86 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.37 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.406 ' O ' ' CG ' ' A' ' 32' ' ' ASN . 59.8 mmm -95.63 -56.76 2.58 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.479 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.409 ' N ' ' O ' ' A' ' 28' ' ' ARG . 3.5 m120 -178.71 93.82 0.22 Allowed Pre-proline 0 CA--C 1.54 0.585 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -81.56 86.42 1.59 Allowed 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.923 1.749 . . . . 0.0 112.113 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -113.21 -16.96 12.46 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.638 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.532 ' CD ' ' N ' ' A' ' 35' ' ' LYS . 9.6 mptt -82.84 -15.54 51.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.364 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 t -71.69 127.43 33.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.438 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.465 ' O ' ' N ' ' A' ' 41' ' ' ARG . 9.6 t -63.87 147.8 51.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.453 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.581 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 1.9 mp0 -47.19 -53.77 12.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.849 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.38 -52.67 64.26 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.877 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.0 m -60.49 -26.41 66.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.599 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 37' ' ' SER . 37.1 ttt85 -70.51 -39.07 74.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.728 -179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -66.04 -33.68 76.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.6 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 65.0 mtm180 -68.24 -40.43 82.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.211 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.98 -52.15 64.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.064 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -50.74 -43.63 58.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.572 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -69.95 -38.8 76.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.831 0.348 . . . . 0.0 110.702 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.415 ' O ' HG12 ' A' ' 51' ' ' VAL . . . -57.74 -22.06 44.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.68 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.79 -46.01 63.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.009 0.433 . . . . 0.0 110.567 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 46.1 mtp85 -76.47 -34.56 58.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.943 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -72.16 -39.31 68.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.649 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.415 HG12 ' O ' ' A' ' 47' ' ' ALA . 5.8 p -75.28 -23.68 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.995 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.56 43.01 8.07 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 111.387 -0.685 . . . . 0.0 111.387 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.592 ' CD2' ' SD ' ' A' ' 12' ' ' MET . 76.8 t80 -94.42 122.16 36.71 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.2 mt -114.23 150.83 44.32 Favored Pre-proline 0 N--CA 1.468 0.442 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.079 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo . . . . . 0 N--CA 1.495 1.563 0 C-N-CA 122.11 1.873 . . . . 0.0 111.808 179.946 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.11 -175.79 3.8 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.454 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.462 HG22 ' H ' ' A' ' 13' ' ' LYS . 22.1 m -142.63 145.69 33.74 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.104 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 13.9 ptt? -54.49 -26.25 30.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.577 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.462 ' H ' HG22 ' A' ' 11' ' ' THR . 29.7 ttpt -71.23 -36.85 71.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.692 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -69.95 -34.5 73.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.963 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.1 t -64.88 -37.08 79.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.613 -0.435 . . . . 0.0 109.951 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.87 -45.68 67.55 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.1 tp -49.89 -38.44 35.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.949 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -68.12 -38.73 82.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.631 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.11 2.35 56.4 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.179 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.446 ' N ' ' O ' ' A' ' 16' ' ' ALA . 49.9 mttp 45.15 53.41 7.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.576 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 92.4 t -85.83 -83.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.806 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 2.9 m 174.84 134.02 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.118 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.3 p -69.0 -28.28 66.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.115 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.23 -39.11 41.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.847 0.356 . . . . 0.0 110.966 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.0 p -57.63 -64.8 0.77 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.078 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 28.1 t -59.56 -27.08 36.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.831 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.9 t -76.65 -39.96 50.61 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.864 -0.335 . . . . 0.0 110.626 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.3 mtt-85 -82.63 -26.75 31.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.935 0.398 . . . . 0.0 110.358 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.473 ' C ' ' H ' ' A' ' 31' ' ' MET . . . -48.43 -47.79 37.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.834 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -56.91 -5.25 0.22 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.253 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.473 ' H ' ' C ' ' A' ' 29' ' ' ALA . 41.0 mtt -121.96 -41.49 2.44 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.883 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -157.27 88.09 2.61 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.642 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -83.1 69.06 7.23 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 122.275 1.983 . . . . 0.0 112.077 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -119.1 -22.74 7.08 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.044 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -77.73 -24.45 49.09 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.746 0.307 . . . . 0.0 110.786 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.83 135.93 27.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.29 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.554 ' O ' ' N ' ' A' ' 41' ' ' ARG . 10.6 t -67.83 151.95 46.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.272 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.613 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 23.1 mp0 -47.68 -55.48 9.37 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.813 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.54 -52.68 64.13 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.533 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 44' ' ' VAL . 65.0 m -60.44 -24.58 65.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.933 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.554 ' N ' ' O ' ' A' ' 37' ' ' SER . 30.8 ttp180 -71.28 -35.51 71.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.71 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -74.69 -41.21 60.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.971 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 44.9 ttt85 -62.46 -47.71 82.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.135 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.474 HG23 ' N ' ' A' ' 45' ' ' GLU . 33.7 m -62.97 -45.07 99.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.18 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.474 ' N ' HG23 ' A' ' 44' ' ' VAL . 37.4 tt0 -50.56 -46.76 57.8 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.437 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -70.25 -34.96 73.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.807 0.337 . . . . 0.0 110.682 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.445 ' O ' HG12 ' A' ' 51' ' ' VAL . . . -58.59 -21.97 54.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.784 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.19 -41.57 66.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.876 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -75.32 -36.64 61.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.14 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -69.82 -42.08 74.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.163 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 47' ' ' ALA . 8.7 p -75.82 -21.11 15.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.787 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 45.94 56.53 6.7 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -76.48 122.08 24.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.775 0.322 . . . . 0.0 110.376 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.1 mt -137.91 152.02 71.4 Favored Pre-proline 0 N--CA 1.465 0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.081 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo . . . . . 0 N--CA 1.494 1.514 0 C-N-CA 122.278 1.985 . . . . 0.0 111.879 179.878 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -95.57 114.78 26.57 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.389 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.413 ' OG1' ' OD2' ' A' ' 14' ' ' ASP . 8.5 p -63.81 153.28 37.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.52 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 25.0 ttt -51.98 -24.88 7.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.327 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.9 mttp -70.63 -44.02 68.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.232 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' OD2' ' OG1' ' A' ' 11' ' ' THR . 36.1 m-20 -56.45 -37.56 70.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.259 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.5 t -58.4 -48.36 85.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.104 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.9 -29.48 28.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.673 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.511 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -67.07 -50.55 61.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.495 -179.649 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -76.06 -48.23 21.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.094 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.59 -4.98 25.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.663 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.9 tttt 42.62 47.06 4.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.487 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.459 HG12 ' OG1' ' A' ' 25' ' ' THR . 19.2 t -69.14 -79.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.278 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.419 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.6 m 165.66 134.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.245 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.9 m -57.11 -28.54 62.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.629 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.94 -41.47 29.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.865 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.459 ' OG1' HG12 ' A' ' 21' ' ' VAL . 15.1 p -57.88 -65.15 0.69 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.847 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.4 p -51.37 -33.22 13.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.863 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.9 t -78.17 -35.49 48.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.017 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 -83.28 -20.17 34.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.085 0.469 . . . . 0.0 110.138 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.449 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -54.6 -19.56 6.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.394 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.541 HD12 ' N ' ' A' ' 30' ' ' LEU . 10.1 mp -88.55 -5.95 57.87 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.635 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 21.3 mmt -121.45 -39.5 2.66 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.844 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -153.95 81.18 4.77 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.634 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -81.55 76.59 4.3 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.379 2.052 . . . . 0.0 111.965 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -158.94 29.25 0.21 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.488 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -121.06 -6.9 9.47 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.608 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.4 t -65.99 133.42 30.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.272 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.542 ' O ' ' N ' ' A' ' 41' ' ' ARG . 1.8 m -50.36 140.35 13.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.319 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -46.92 -53.61 11.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.609 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.31 -52.1 65.79 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.442 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.463 ' O ' HG23 ' A' ' 44' ' ' VAL . 88.1 m -65.19 -22.02 66.84 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.762 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.542 ' N ' ' O ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -70.64 -45.61 64.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.953 0.406 . . . . 0.0 110.249 179.685 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -67.53 -35.87 79.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.917 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.8 mtm180 -68.32 -34.89 76.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.584 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 24.8 t -67.46 -45.95 84.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -51.09 -55.63 16.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.147 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -71.38 -37.61 71.58 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.328 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.38 -22.03 61.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.1 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -72.84 -43.32 62.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.727 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -67.34 -34.62 77.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.575 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -60.07 -48.93 79.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.631 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.7 m -75.73 -8.87 12.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.587 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 49.76 53.75 20.41 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -80.67 133.97 35.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.779 0.323 . . . . 0.0 110.39 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.2 mt -136.94 151.59 72.49 Favored Pre-proline 0 N--CA 1.465 0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.999 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo . . . . . 0 N--CA 1.495 1.565 0 C-N-CA 122.21 1.94 . . . . 0.0 111.876 179.919 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.406 -0.591 . . . . 283.32999999999998 109.406 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -101.56 -172.62 2.19 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.116 -0.493 . . . . 150.80000000000001 110.343 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.408 ' OG1' ' OD2' ' A' ' 14' ' ' ASP . 7.7 p -145.67 153.4 40.97 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.258 -0.428 . . . . 140.56999999999999 110.053 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 3.2 mtp -52.48 -26.28 12.48 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.679 -0.489 . . . . 647.38 109.679 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.7 ttmt -71.64 -40.41 69.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.08 -0.509 . . . . 414.97000000000003 110.568 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.408 ' OD2' ' OG1' ' A' ' 11' ' ' THR . 54.2 m-20 -64.41 -33.76 76.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.324 -0.398 . . . . 336.18000000000001 110.471 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.4 t -64.15 -40.03 87.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 51.060000000000002 110.562 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.42 -42.4 64.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.981 0.42 . . . . 20.120000000000001 109.952 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.546 HD23 ' O ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -58.16 -40.24 80.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.842 -0.617 . . . . 224.53 109.672 179.647 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -67.63 -36.28 80.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 621.42999999999995 110.873 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.18 5.4 50.21 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.929 0.395 . . . . 30.77 110.207 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 16' ' ' ALA . 82.0 mttt 41.66 47.01 3.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.942 -0.572 . . . . 567.58000000000004 110.73 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.425 ' O ' ' OG ' ' A' ' 22' ' ' SER . 16.8 t -69.61 -80.07 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.888 -0.597 . . . . 66.439999999999998 110.739 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.425 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 1.8 m 167.01 131.68 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.041 -0.527 . . . . 124.63 110.097 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.2 m -57.36 -28.69 63.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.202 -0.454 . . . . 161.56999999999999 110.929 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.16 -40.87 29.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.819 0.342 . . . . 33.359999999999999 111.135 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.3 p -57.6 -64.69 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.161 -0.472 . . . . 27.440000000000001 110.048 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.5 p -54.48 -31.94 23.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.377 -0.374 . . . . 159.62 111.093 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.2 t -73.65 -36.7 65.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.342 -0.39 . . . . 155.36000000000001 111.071 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -82.2 -19.42 39.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.991 0.425 . . . . 775.5 110.365 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.29 -19.8 5.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.828 -0.624 . . . . 85.129999999999995 111.153 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.2 mt -88.09 -9.6 52.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.709 0.29 . . . . 569.50999999999999 110.862 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 7.5 mmt -115.99 -38.39 3.65 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.46 -0.336 . . . . 306.42000000000002 110.735 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -155.89 87.1 3.08 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 364.5 110.479 -179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.83 73.15 6.15 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 122.162 1.908 . . . . 203.0 112.075 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -155.05 26.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.955 -0.566 . . . . 999.99000000000001 110.426 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -111.89 -19.99 12.19 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.128 -0.487 . . . . 999.99000000000001 110.135 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.1 t -65.97 143.17 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.055 -0.52 . . . . 152.69999999999999 110.432 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.538 ' O ' ' N ' ' A' ' 41' ' ' ARG . 5.6 t -61.16 145.44 51.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 183.09999999999999 110.32 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -47.71 -52.23 19.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.164 -0.471 . . . . 606.50999999999999 110.966 -179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.87 -52.87 62.38 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.229 -0.589 . . . . 41.5 110.229 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 72.1 m -65.17 -22.36 66.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.16 -0.473 . . . . 57.18 110.896 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 37' ' ' SER . 63.0 ttt180 -71.23 -41.34 70.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 885.63999999999999 110.846 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -68.14 -32.02 72.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.897 0.379 . . . . 378.75 110.762 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.6 mtp180 -69.39 -46.01 67.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.099 -0.5 . . . . 499.13999999999999 109.983 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.68 -50.73 78.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.941 -0.572 . . . . 164.41999999999999 110.235 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -50.57 -50.53 53.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.254 -0.43 . . . . 357.44999999999999 110.829 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -70.21 -34.97 73.56 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.887 -0.325 . . . . 678.14999999999998 110.561 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.61 -22.08 61.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.438 . . . . 54.049999999999997 110.53 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.36 -46.37 88.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.442 . . . . 40.590000000000003 110.534 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -75.78 -34.58 60.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 999.99000000000001 110.881 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -59.49 -45.83 90.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.362 -0.381 . . . . 396.76999999999998 111.326 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.5 p -75.35 -16.7 15.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 C-N-CA 120.853 -0.339 . . . . 199.31 110.723 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.71 53.82 43.04 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 111.474 -0.65 . . . . 130.71000000000001 111.474 179.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -107.63 149.01 28.58 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.766 0.317 . . . . 613.10000000000002 110.259 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.3 mt -140.08 152.05 66.51 Favored Pre-proline 0 N--CA 1.466 0.344 0 CA-C-N 116.218 -0.446 . . . . 999.99000000000001 109.974 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo . . . . . 0 N--CA 1.495 1.559 0 C-N-CA 122.148 1.899 . . . . 999.99000000000001 111.891 179.944 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.417 ' HB3' HG13 ' A' ' 51' ' ' VAL . . . . . . . . 0 N--CA 1.462 0.161 0 CA-C-O 120.781 0.324 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.446 HG22 ' H ' ' A' ' 13' ' ' LYS . 24.8 m -143.55 148.69 36.33 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.361 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 10.5 ptt? -53.62 -27.26 26.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.708 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.446 ' H ' HG22 ' A' ' 11' ' ' THR . 32.4 ttmt -72.54 -41.88 65.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.662 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -63.07 -34.74 78.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.479 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.409 ' CG2' HG21 ' A' ' 51' ' ' VAL . 54.3 t -64.59 -37.44 80.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.589 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.55 -46.18 66.69 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.007 0.432 . . . . 0.0 110.006 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.4 mt -66.98 -39.35 87.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.306 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -65.02 -32.47 74.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.983 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.39 12.7 31.28 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.76 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt 35.46 47.9 0.38 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.319 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.429 ' O ' ' OG ' ' A' ' 22' ' ' SER . 11.4 t -69.03 -79.99 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.814 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 1.6 m 167.09 129.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.267 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.2 t -51.55 -29.7 17.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.972 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.55 -41.23 27.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.864 0.364 . . . . 0.0 111.227 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.41 ' OG1' HG12 ' A' ' 21' ' ' VAL . 15.8 p -57.68 -64.88 0.75 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.85 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.4 p -50.87 -34.68 13.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.721 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.9 t -76.63 -32.52 58.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.78 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 31' ' ' MET . 52.4 mmt-85 -82.45 -19.54 38.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.131 0.491 . . . . 0.0 110.103 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.79 -20.04 0.44 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.005 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 pp -102.61 -16.04 16.19 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.718 0.294 . . . . 0.0 110.484 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.409 ' N ' ' O ' ' A' ' 28' ' ' ARG . 41.6 mtt -100.28 -53.5 3.1 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.476 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -143.97 83.37 10.37 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.347 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -80.93 63.06 8.74 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.278 1.986 . . . . 0.0 112.039 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -154.85 34.69 0.4 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.433 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -124.32 -14.73 6.89 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.31 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 97.2 t -65.88 144.56 14.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.066 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.519 ' O ' ' N ' ' A' ' 41' ' ' ARG . 5.6 t -59.6 144.9 46.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.163 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -47.7 -53.85 13.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.637 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.06 -53.15 61.15 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.364 -0.534 . . . . 0.0 109.812 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 86.5 m -62.18 -24.7 67.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.836 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' A' ' 37' ' ' SER . 41.6 ttp180 -70.57 -42.84 70.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.673 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.0 t-20 -65.61 -33.67 76.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.729 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -68.71 -43.38 76.12 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.947 0.403 . . . . 0.0 110.254 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 47.4 t -58.37 -50.55 78.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.155 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -50.61 -50.08 54.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.613 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -70.24 -39.56 74.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.779 0.324 . . . . 0.0 110.672 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.7 -23.54 66.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.736 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.472 ' O ' ' N ' ' A' ' 52' ' ' GLY . . . -73.02 -38.35 66.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.782 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -68.27 -38.0 81.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.927 0.394 . . . . 0.0 110.362 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -59.4 -51.02 71.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.217 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.417 HG13 ' HB3' ' A' ' 10' ' ' ALA . 72.1 t -82.53 -24.45 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.698 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.472 ' N ' ' O ' ' A' ' 48' ' ' ALA . . . . . . . . 0 CA--C 1.527 0.835 0 N-CA-C 112.132 -0.387 . . . . 0.0 112.132 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.196 0 CA-C-O 120.862 0.363 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.4 m -143.66 148.96 36.55 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.226 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 11.5 tpt -48.26 -30.0 4.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.691 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -74.55 -42.01 59.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.693 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -62.0 -34.51 76.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.87 0.367 . . . . 0.0 110.588 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.5 t -62.03 -40.51 87.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.259 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.494 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.86 -41.77 64.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.409 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.6 tp -59.95 -42.86 94.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.322 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -63.89 -33.32 75.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.769 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.429 ' HB3' HG23 ' A' ' 21' ' ' VAL . . . -103.65 5.68 36.57 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.753 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 16' ' ' ALA . 65.9 mttm 41.41 46.98 3.04 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.078 0.466 . . . . 0.0 110.641 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.429 HG23 ' HB3' ' A' ' 19' ' ' ALA . 80.0 t -70.07 -81.87 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.137 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.431 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.5 t 171.36 129.74 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.335 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 35.6 m -62.92 -28.61 70.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.728 -179.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.65 -38.85 32.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.918 0.39 . . . . 0.0 111.253 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' A' ' 22' ' ' SER . 17.9 p -56.63 -64.48 0.86 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.838 -178.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.9 t -51.54 -25.52 5.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.2 p -77.15 -31.49 55.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.377 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' A' ' 32' ' ' ASN . 97.4 mtt180 -82.07 -19.48 40.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.217 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.46 -19.92 0.99 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.108 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.564 ' N ' HD12 ' A' ' 30' ' ' LEU . 9.7 mp -97.12 -12.28 23.32 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.564 0.221 . . . . 0.0 110.924 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 20.2 mmt -121.62 -52.08 2.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.803 0.335 . . . . 0.0 110.894 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 28' ' ' ARG . 9.6 t-20 -130.22 80.6 70.38 Favored Pre-proline 0 N--CA 1.466 0.339 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.382 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.99 61.61 7.88 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 C-N-CA 122.475 2.117 . . . . 0.0 112.298 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -161.68 44.53 0.16 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.622 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -127.18 -20.69 4.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.632 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.1 t -66.59 141.93 17.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.536 ' O ' ' N ' ' A' ' 41' ' ' ARG . 1.6 m -58.43 143.3 45.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.791 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -47.48 -53.87 13.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.739 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.49 -52.26 66.4 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.805 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.457 ' O ' HG23 ' A' ' 44' ' ' VAL . 95.5 m -64.68 -22.01 66.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.887 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.536 ' N ' ' O ' ' A' ' 37' ' ' SER . 16.9 tpt180 -71.01 -42.21 69.88 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.614 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.536 ' N ' HD22 ' A' ' 42' ' ' ASN . 1.2 m-80 -68.76 -36.32 78.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.864 0.364 . . . . 0.0 110.765 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 45.3 ttm-85 -68.11 -44.14 76.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.107 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.511 ' O ' ' N ' ' A' ' 48' ' ' ALA . 37.2 t -58.88 -48.89 84.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.911 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.6 tt0 -50.11 -50.82 47.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.61 -179.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -70.3 -35.53 73.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.85 0.357 . . . . 0.0 110.576 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.81 -23.61 60.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.409 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -68.01 -39.2 83.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.61 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -71.87 -34.51 69.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.331 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -53.84 -50.71 65.61 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.546 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.467 HG22 ' O ' ' A' ' 51' ' ' VAL . 7.4 p -79.43 -8.24 11.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.535 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.758 0 N-CA-C 111.647 -0.581 . . . . 0.0 111.647 179.109 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.169 0 CA-C-O 120.714 0.292 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 13' ' ' LYS . 28.0 m -146.33 149.56 34.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.367 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 63.3 mtt -50.89 -25.27 4.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.481 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.424 ' H ' HG22 ' A' ' 11' ' ' THR . 35.9 ttpt -75.57 -43.25 49.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.951 -179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -62.35 -33.95 75.7 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.636 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.413 HG11 ' HB1' ' A' ' 47' ' ' ALA . 77.8 t -65.15 -37.39 80.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.591 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.36 -45.2 65.65 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.7 tp -54.09 -41.5 68.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.32 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -69.9 -42.83 72.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.028 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.61 -0.38 37.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.153 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp 42.91 33.43 0.5 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.974 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.436 HG23 ' H ' ' A' ' 22' ' ' SER . 0.0 OUTLIER -70.35 -74.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.131 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.436 ' H ' HG23 ' A' ' 21' ' ' VAL . 2.0 t 172.35 139.37 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.352 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.8 m -67.66 -28.87 68.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.045 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.08 -38.31 44.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.977 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.0 p -57.62 -64.85 0.76 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.129 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.3 p -50.81 -27.67 5.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.191 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.3 p -82.75 -34.78 27.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.047 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.0 mtt-85 -81.81 -30.48 32.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.853 0.358 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.495 ' C ' ' H ' ' A' ' 31' ' ' MET . . . -53.97 -54.91 32.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.615 -179.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.7 mt -49.77 -10.25 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.843 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.495 ' H ' ' C ' ' A' ' 29' ' ' ALA . 15.6 mmt -115.33 -36.16 4.41 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.857 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' A' ' 34' ' ' ASP . 25.6 m120 -156.01 81.94 3.68 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.822 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -63.33 54.62 0.16 Allowed 'Trans proline' 0 N--CA 1.501 1.928 0 C-N-CA 122.97 2.447 . . . . 0.0 112.451 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' ASN . 19.6 t70 -122.94 -29.56 3.92 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.979 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -66.6 -23.55 66.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.755 0.312 . . . . 0.0 110.735 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.0 m -69.03 139.57 20.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.413 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.522 ' O ' ' N ' ' A' ' 41' ' ' ARG . 58.6 m -71.72 159.31 34.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.228 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -47.06 -58.61 3.83 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.224 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.83 -52.89 63.31 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.099 -0.64 . . . . 0.0 109.452 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.482 ' O ' HG23 ' A' ' 44' ' ' VAL . 53.4 m -58.52 -25.64 62.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.711 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 37' ' ' SER . 20.1 ttm180 -70.47 -39.32 74.31 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.874 0.369 . . . . 0.0 110.4 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -71.49 -45.55 62.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.942 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.6 ttm180 -63.43 -43.33 97.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.951 0.405 . . . . 0.0 110.067 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 40' ' ' THR . 25.1 t -60.18 -51.83 68.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.851 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -51.0 -44.76 60.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.849 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 55.5 mttm -70.07 -38.26 75.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.669 0.271 . . . . 0.0 110.713 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.421 ' O ' HG12 ' A' ' 51' ' ' VAL . . . -57.42 -22.61 44.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.75 -179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.09 -44.74 79.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.834 0.35 . . . . 0.0 110.468 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -76.44 -43.6 39.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.964 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 60.1 tt0 -59.57 -42.71 93.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.702 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.421 HG12 ' O ' ' A' ' 47' ' ' ALA . 6.3 p -75.6 -22.83 16.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.964 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.668 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.948 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.288 0 CA-C-O 120.872 0.368 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.3 p -57.79 155.52 10.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.365 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 70.4 mtp -48.86 -24.69 1.54 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.203 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.45 ' CB ' ' NZ ' ' A' ' 13' ' ' LYS . 8.5 mtmp? -72.44 -42.97 64.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.461 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -57.61 -38.37 74.82 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.821 0.343 . . . . 0.0 110.394 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.53 -47.05 89.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.408 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.58 -29.92 28.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.405 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.518 ' O ' HD23 ' A' ' 17' ' ' LEU . 0.9 OUTLIER -64.82 -48.08 75.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.055 179.977 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -71.3 -37.77 71.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.08 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.401 ' HB3' HG23 ' A' ' 21' ' ' VAL . . . -88.84 -1.8 58.27 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.864 0.364 . . . . 0.0 110.434 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.46 ' N ' ' O ' ' A' ' 16' ' ' ALA . 40.7 mtmt 43.32 47.25 5.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.705 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' A' ' 22' ' ' SER . 30.2 t -70.05 -79.54 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.662 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.442 ' OG ' ' CG2' ' A' ' 25' ' ' THR . 1.0 OUTLIER 165.78 134.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.111 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.6 m -60.88 -27.87 68.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.425 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.71 -40.93 39.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.836 0.35 . . . . 0.0 111.073 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.442 ' CG2' ' OG ' ' A' ' 22' ' ' SER . 12.3 p -58.33 -65.53 0.64 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.926 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.9 p -53.73 -33.91 23.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.997 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.8 t -75.02 -37.1 61.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.682 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.3 mmt85 -82.46 -20.43 36.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.287 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -70.96 -20.5 62.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.896 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.7 mt -61.61 -25.58 67.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.72 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 67.3 mtm -122.35 -14.59 7.84 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.852 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -151.69 82.23 5.65 Favored Pre-proline 0 N--CA 1.464 0.25 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.638 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -79.9 73.92 5.79 Favored 'Trans proline' 0 N--CA 1.492 1.427 0 C-N-CA 122.203 1.935 . . . . 0.0 112.123 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -160.6 28.99 0.16 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.52 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -106.6 -23.19 12.53 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.422 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.456 HG22 ' H ' ' A' ' 36' ' ' VAL . 2.6 m -65.75 145.59 13.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.943 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.566 ' O ' ' N ' ' A' ' 41' ' ' ARG . 16.1 t -64.22 153.66 37.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.141 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.558 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 3.1 mp0 -46.81 -56.43 6.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.851 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.39 -51.9 67.92 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 119.944 -0.703 . . . . 0.0 109.654 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.43 ' O ' HG13 ' A' ' 44' ' ' VAL . 97.2 m -63.06 -21.81 66.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.248 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.566 ' N ' ' O ' ' A' ' 37' ' ' SER . 32.9 ttp180 -71.45 -37.38 71.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.906 0.384 . . . . 0.0 110.967 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -74.56 -39.18 62.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.063 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -64.34 -48.1 76.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.024 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.48 HG23 ' N ' ' A' ' 45' ' ' GLU . 34.1 m -62.2 -45.13 99.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.042 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.48 ' N ' HG23 ' A' ' 44' ' ' VAL . 32.8 tt0 -51.04 -50.64 58.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.88 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.1 mmtp -71.62 -33.77 69.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.851 0.358 . . . . 0.0 111.108 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.32 -21.81 61.27 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.074 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.15 -37.86 72.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.803 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -72.65 -38.72 67.58 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.432 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -54.72 -45.78 74.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.742 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.3 m -75.78 -0.8 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.646 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.717 0 N-CA-C 111.174 -0.771 . . . . 0.0 111.174 179.909 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.422 0 CA-C-O 120.738 0.304 . . . . 0.0 110.335 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.3 p -61.01 168.81 2.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.398 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.3 ttt -57.09 -24.81 56.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.279 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -68.4 -40.33 81.33 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.193 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -63.3 -36.98 85.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.49 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 92.9 t -58.27 -45.18 89.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.748 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.73 -40.24 62.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.989 0.423 . . . . 0.0 110.401 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.2 tp -56.55 -45.76 81.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.8 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -69.01 -33.94 74.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.293 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.14 -1.39 57.75 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.696 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 46.12 45.61 12.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.977 0.417 . . . . 0.0 110.64 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.41 ' O ' ' CB ' ' A' ' 22' ' ' SER . 21.6 t -69.61 -78.11 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.089 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.41 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.5 t 165.92 136.79 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.422 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.0 m -61.75 -28.07 69.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.067 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.86 -39.84 42.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.819 0.342 . . . . 0.0 111.067 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 22' ' ' SER . 19.9 p -57.66 -65.13 0.68 Allowed 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.791 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.9 p -52.3 -31.4 14.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.784 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.5 t -76.2 -36.13 58.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.724 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -79.36 -19.46 50.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.019 0.438 . . . . 0.0 110.276 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.01 -20.04 61.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.693 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 23.7 mt -63.25 -22.31 66.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.403 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 8.3 ptp -121.59 -13.1 8.42 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.581 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -152.24 68.6 7.28 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.505 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.66 161.56 19.12 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.895 2.396 . . . . 0.0 112.337 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 78.38 25.38 0.58 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.473 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -127.07 17.66 7.2 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.319 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 17.4 m -77.02 162.63 4.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.492 ' O ' ' N ' ' A' ' 41' ' ' ARG . 40.9 t -46.13 146.46 1.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.903 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.428 ' CG ' ' N ' ' A' ' 39' ' ' ALA . 14.7 pt20 -47.49 -44.95 25.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.604 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.428 ' N ' ' CG ' ' A' ' 38' ' ' GLN . . . -63.02 -52.93 60.98 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.446 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 85.2 m -64.44 -22.55 66.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.618 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 37' ' ' SER . 33.5 ttt85 -70.05 -44.9 68.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.032 0.444 . . . . 0.0 110.183 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -74.54 -43.67 54.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.875 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 63.1 mtp180 -65.8 -43.56 88.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.607 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.3 p -65.05 -41.24 91.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 119.842 -0.743 . . . . 0.0 110.327 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -51.26 -50.69 58.73 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.558 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -71.58 -35.48 70.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.838 0.352 . . . . 0.0 111.068 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.18 -21.21 65.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.21 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.03 -47.35 59.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.869 0.366 . . . . 0.0 110.494 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -74.0 -41.7 61.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.922 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -60.61 -50.51 73.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.851 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 51' ' ' VAL . 45.4 t -76.41 -6.45 8.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.026 0.441 . . . . 0.0 110.334 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.741 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.625 179.186 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.405 ' HB3' HG23 ' A' ' 51' ' ' VAL . . . . . . . . 0 N--CA 1.463 0.197 0 CA-C-O 120.797 0.332 . . . . 0.0 110.528 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 p -143.58 146.96 33.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.971 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.1 ptm -47.95 -26.25 1.67 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.917 0.389 . . . . 0.0 110.417 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -78.66 -47.26 17.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.568 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -57.61 -36.69 72.12 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 120.872 0.367 . . . . 0.0 110.555 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.6 t -58.42 -45.13 89.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.592 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.73 -41.2 63.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.753 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.7 mt -76.06 -45.27 35.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.588 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.55 -42.97 84.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.876 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.96 16.65 24.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.672 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.9 pttm 35.88 47.74 0.44 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.104 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.401 ' O ' ' CB ' ' A' ' 22' ' ' SER . 17.2 t -68.67 -78.01 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.593 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.401 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.4 t 168.58 138.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.496 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 26.1 m -68.29 -28.04 66.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.818 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.9 -43.8 24.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.837 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.441 ' O ' ' N ' ' A' ' 29' ' ' ALA . 53.0 p -58.21 -65.04 0.71 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.144 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p -50.95 -29.37 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.069 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.6 m -82.08 -36.94 27.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.751 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -82.78 -19.58 37.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.282 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.441 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -48.87 -53.63 18.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.597 -179.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.02 -10.02 57.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.073 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 41.1 mtp -94.17 -52.09 4.53 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.041 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -160.83 86.9 1.76 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.753 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -47.7 107.09 0.12 Allowed 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.404 2.069 . . . . 0.0 111.894 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.495 ' C ' ' H ' ' A' ' 36' ' ' VAL . 29.4 t70 -176.74 -31.22 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.569 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.2 mmmm -66.12 11.37 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.51 -178.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.495 ' H ' ' C ' ' A' ' 34' ' ' ASP . 3.5 m -107.38 127.93 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.541 ' O ' ' N ' ' A' ' 41' ' ' ARG . 39.6 t -72.42 164.59 26.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.534 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -47.6 -54.92 10.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.329 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.33 -53.35 59.27 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.575 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.454 ' O ' HG23 ' A' ' 44' ' ' VAL . 52.0 m -62.2 -23.26 66.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.045 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -71.26 -44.78 64.6 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.296 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -70.02 -42.68 72.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.12 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 71.3 mtp85 -65.36 -45.36 84.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 110.252 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 28.0 t -60.15 -48.13 89.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.054 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -51.14 -51.67 51.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.739 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -70.23 -39.94 74.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.798 0.333 . . . . 0.0 110.87 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.95 -23.05 61.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.889 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.58 -39.36 64.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.6 ttp180 -69.85 -35.26 74.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.027 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -55.88 -49.86 72.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.47 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.497 HG22 ' O ' ' A' ' 51' ' ' VAL . 7.9 p -75.42 -7.16 9.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.782 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.526 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 179.375 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.739 0.304 . . . . 0.0 110.431 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.0 p -140.65 145.45 36.61 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.159 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 22.4 ttt -59.87 -25.17 64.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.633 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -71.78 -46.73 57.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.208 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -61.93 -33.02 73.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.423 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 52.4 t -61.47 -45.98 97.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.612 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.54 -37.47 57.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.528 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.517 ' O ' HD23 ' A' ' 17' ' ' LEU . 0.9 OUTLIER -62.94 -46.35 88.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.022 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -66.54 -33.96 76.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.038 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.419 ' HB3' HG23 ' A' ' 21' ' ' VAL . . . -93.64 5.9 50.08 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.381 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.5 ttmt 41.2 45.35 2.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.993 0.425 . . . . 0.0 110.669 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.436 ' O ' ' CB ' ' A' ' 22' ' ' SER . 21.2 t -69.46 -78.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.795 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.6 m 165.87 136.69 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.139 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.6 p -64.65 -28.44 69.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.0 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.03 -40.99 29.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.058 0.456 . . . . 0.0 110.706 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.6 p -57.15 -64.25 0.94 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.165 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p -50.15 -27.02 3.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.825 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.7 m -80.13 -32.06 38.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -82.09 -19.37 40.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.179 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.17 -19.47 64.0 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.58 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.2 mt -86.63 -15.63 39.13 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.204 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.1 mmt -100.31 -32.2 10.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.416 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -160.18 147.42 12.5 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.435 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.53 -45.12 0.13 Allowed 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.257 1.971 . . . . 0.0 112.253 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -69.65 55.41 0.12 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.42 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -127.41 -5.8 5.92 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.902 0.382 . . . . 0.0 110.303 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.1 m -104.52 142.79 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.282 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.525 ' O ' ' N ' ' A' ' 41' ' ' ARG . 39.6 m -66.01 160.01 24.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.168 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.64 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -47.42 -48.49 26.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.41 -179.427 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.43 -53.16 56.64 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.221 -0.592 . . . . 0.0 109.643 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.7 m -62.3 -22.88 66.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.774 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.525 ' N ' ' O ' ' A' ' 37' ' ' SER . 56.9 ttt180 -71.46 -44.2 65.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.613 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -72.32 -42.78 65.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.465 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -65.12 -45.06 86.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.836 0.351 . . . . 0.0 110.591 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 25.4 t -60.79 -45.57 97.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.987 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -50.95 -52.52 41.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.68 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -71.69 -38.07 70.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.726 0.298 . . . . 0.0 111.071 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.61 -22.21 61.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.92 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.15 -42.8 62.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.447 ' CA ' ' HE ' ' A' ' 49' ' ' ARG . 0.0 OUTLIER -64.74 -34.78 79.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.313 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -53.49 -50.45 65.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.189 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.525 ' O ' HG12 ' A' ' 51' ' ' VAL . 61.4 t -90.95 -3.35 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.111 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.775 0 N-CA-C 111.624 -0.59 . . . . 0.0 111.624 179.451 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.157 0 CA-C-O 120.793 0.33 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.5 p -140.83 146.41 37.54 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.175 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.2 mtm -56.9 -24.86 55.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.6 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 53.2 mttm -71.88 -41.62 67.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.889 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -66.28 -37.51 85.61 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.046 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 74.9 t -67.25 -32.63 58.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.476 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.59 -46.53 66.97 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.548 -0.461 . . . . 0.0 109.813 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 mt -60.78 -33.04 72.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.984 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -63.39 -33.54 75.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.33 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.08 7.23 38.91 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.358 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.456 ' CB ' ' NZ ' ' A' ' 20' ' ' LYS . 7.8 mtpm? 42.97 49.12 5.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.615 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.0 t -72.49 -81.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.695 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.8 m 168.28 131.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.959 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.1 p -56.26 -28.88 60.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.0 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.63 -40.72 28.6 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.165 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.4 p -57.3 -64.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.177 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.3 p -50.55 -31.23 8.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.891 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.0 m -73.19 -29.62 62.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.854 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 32' ' ' ASN . 58.7 mtp85 -78.16 -19.31 54.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.95 0.405 . . . . 0.0 110.563 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.476 ' C ' HD12 ' A' ' 30' ' ' LEU . . . -48.58 -20.37 0.44 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.754 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.476 HD12 ' C ' ' A' ' 29' ' ' ALA . 9.1 mp -103.71 -26.17 12.86 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.37 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.406 ' O ' ' CG ' ' A' ' 32' ' ' ASN . 59.8 mmm -95.63 -56.76 2.58 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.479 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.409 ' N ' ' O ' ' A' ' 28' ' ' ARG . 3.5 m120 -178.71 93.82 0.22 Allowed Pre-proline 0 CA--C 1.54 0.585 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -81.56 86.42 1.59 Allowed 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.923 1.749 . . . . 0.0 112.113 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -113.21 -16.96 12.46 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.638 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.532 ' CD ' ' N ' ' A' ' 35' ' ' LYS . 9.6 mptt -82.84 -15.54 51.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.364 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 t -71.69 127.43 33.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.438 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.465 ' O ' ' N ' ' A' ' 41' ' ' ARG . 9.6 t -63.87 147.8 51.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.453 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.581 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 1.9 mp0 -47.19 -53.77 12.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.849 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.38 -52.67 64.26 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.877 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.0 m -60.49 -26.41 66.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.599 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 37' ' ' SER . 37.1 ttt85 -70.51 -39.07 74.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.728 -179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -66.04 -33.68 76.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.6 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 65.0 mtm180 -68.24 -40.43 82.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.211 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.98 -52.15 64.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.064 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -50.74 -43.63 58.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.572 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -69.95 -38.8 76.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.831 0.348 . . . . 0.0 110.702 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.415 ' O ' HG12 ' A' ' 51' ' ' VAL . . . -57.74 -22.06 44.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.68 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.79 -46.01 63.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.009 0.433 . . . . 0.0 110.567 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 46.1 mtp85 -76.47 -34.56 58.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.943 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -72.16 -39.31 68.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.649 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.415 HG12 ' O ' ' A' ' 47' ' ' ALA . 5.8 p -75.28 -23.68 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.995 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.751 0 N-CA-C 111.387 -0.685 . . . . 0.0 111.387 179.592 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.272 0 CA-C-O 120.806 0.336 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.462 HG22 ' H ' ' A' ' 13' ' ' LYS . 22.1 m -142.63 145.69 33.74 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.104 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 13.9 ptt? -54.49 -26.25 30.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.577 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.462 ' H ' HG22 ' A' ' 11' ' ' THR . 29.7 ttpt -71.23 -36.85 71.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.692 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -69.95 -34.5 73.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.963 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.1 t -64.88 -37.08 79.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.613 -0.435 . . . . 0.0 109.951 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.87 -45.68 67.55 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.1 tp -49.89 -38.44 35.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.949 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -68.12 -38.73 82.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.631 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.11 2.35 56.4 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.179 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.446 ' N ' ' O ' ' A' ' 16' ' ' ALA . 49.9 mttp 45.15 53.41 7.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.576 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 92.4 t -85.83 -83.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.806 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 2.9 m 174.84 134.02 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.118 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.3 p -69.0 -28.28 66.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.115 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.23 -39.11 41.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.847 0.356 . . . . 0.0 110.966 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.0 p -57.63 -64.8 0.77 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.078 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 28.1 t -59.56 -27.08 36.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.831 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.9 t -76.65 -39.96 50.61 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.864 -0.335 . . . . 0.0 110.626 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.3 mtt-85 -82.63 -26.75 31.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.935 0.398 . . . . 0.0 110.358 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.473 ' C ' ' H ' ' A' ' 31' ' ' MET . . . -48.43 -47.79 37.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.834 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -56.91 -5.25 0.22 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.253 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.473 ' H ' ' C ' ' A' ' 29' ' ' ALA . 41.0 mtt -121.96 -41.49 2.44 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.883 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -157.27 88.09 2.61 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.642 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -83.1 69.06 7.23 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 122.275 1.983 . . . . 0.0 112.077 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -119.1 -22.74 7.08 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.044 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -77.73 -24.45 49.09 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.746 0.307 . . . . 0.0 110.786 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.83 135.93 27.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.29 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.554 ' O ' ' N ' ' A' ' 41' ' ' ARG . 10.6 t -67.83 151.95 46.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.272 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.613 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 23.1 mp0 -47.68 -55.48 9.37 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.813 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.54 -52.68 64.13 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.533 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 44' ' ' VAL . 65.0 m -60.44 -24.58 65.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.933 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.554 ' N ' ' O ' ' A' ' 37' ' ' SER . 30.8 ttp180 -71.28 -35.51 71.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.71 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -74.69 -41.21 60.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.971 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 44.9 ttt85 -62.46 -47.71 82.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.135 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.474 HG23 ' N ' ' A' ' 45' ' ' GLU . 33.7 m -62.97 -45.07 99.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.18 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.474 ' N ' HG23 ' A' ' 44' ' ' VAL . 37.4 tt0 -50.56 -46.76 57.8 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.437 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -70.25 -34.96 73.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.807 0.337 . . . . 0.0 110.682 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.445 ' O ' HG12 ' A' ' 51' ' ' VAL . . . -58.59 -21.97 54.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.784 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.19 -41.57 66.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.876 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -75.32 -36.64 61.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.14 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -69.82 -42.08 74.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.163 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 47' ' ' ALA . 8.7 p -75.82 -21.11 15.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.787 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.742 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 179.928 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.229 0 CA-C-O 120.891 0.376 . . . . 0.0 110.389 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.413 ' OG1' ' OD2' ' A' ' 14' ' ' ASP . 8.5 p -63.81 153.28 37.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.52 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 25.0 ttt -51.98 -24.88 7.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.327 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.9 mttp -70.63 -44.02 68.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.232 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.413 ' OD2' ' OG1' ' A' ' 11' ' ' THR . 36.1 m-20 -56.45 -37.56 70.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.259 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.5 t -58.4 -48.36 85.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.104 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.9 -29.48 28.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.673 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.511 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -67.07 -50.55 61.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.495 -179.649 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -76.06 -48.23 21.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.094 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.59 -4.98 25.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.663 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.9 tttt 42.62 47.06 4.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.487 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.459 HG12 ' OG1' ' A' ' 25' ' ' THR . 19.2 t -69.14 -79.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.278 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.419 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.6 m 165.66 134.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.245 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.9 m -57.11 -28.54 62.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.629 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.94 -41.47 29.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.865 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.459 ' OG1' HG12 ' A' ' 21' ' ' VAL . 15.1 p -57.88 -65.15 0.69 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.847 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.4 p -51.37 -33.22 13.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.863 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.9 t -78.17 -35.49 48.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.017 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 -83.28 -20.17 34.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.085 0.469 . . . . 0.0 110.138 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.449 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -54.6 -19.56 6.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.394 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.541 ' N ' HD12 ' A' ' 30' ' ' LEU . 10.1 mp -88.55 -5.95 57.87 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.635 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 21.3 mmt -121.45 -39.5 2.66 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.844 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -153.95 81.18 4.77 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.634 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -81.55 76.59 4.3 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.379 2.052 . . . . 0.0 111.965 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -158.94 29.25 0.21 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.488 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -121.06 -6.9 9.47 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.608 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.4 t -65.99 133.42 30.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.272 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.542 ' O ' ' N ' ' A' ' 41' ' ' ARG . 1.8 m -50.36 140.35 13.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.319 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -46.92 -53.61 11.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.609 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.31 -52.1 65.79 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.442 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.463 ' O ' HG23 ' A' ' 44' ' ' VAL . 88.1 m -65.19 -22.02 66.84 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.762 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.542 ' N ' ' O ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -70.64 -45.61 64.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.953 0.406 . . . . 0.0 110.249 179.685 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -67.53 -35.87 79.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.917 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.8 mtm180 -68.32 -34.89 76.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.584 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 24.8 t -67.46 -45.95 84.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -51.09 -55.63 16.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.147 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -71.38 -37.61 71.58 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.328 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.38 -22.03 61.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.1 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -72.84 -43.32 62.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.727 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -67.34 -34.62 77.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.575 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -60.07 -48.93 79.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.631 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.7 m -75.73 -8.87 12.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.587 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.668 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.986 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.289 0 CA-C-O 120.771 0.32 . . . . 150.8 110.343 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.408 ' OG1' ' OD2' ' A' ' 14' ' ' ASP . 7.7 p -145.67 153.4 40.97 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.258 -0.428 . . . . 140.57 110.053 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 3.2 mtp -52.48 -26.28 12.48 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.679 -0.489 . . . . 647.38 109.679 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.7 ttmt -71.64 -40.41 69.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.08 -0.509 . . . . 414.97 110.568 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.408 ' OD2' ' OG1' ' A' ' 11' ' ' THR . 54.2 m-20 -64.41 -33.76 76.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.324 -0.398 . . . . 336.18 110.471 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.4 t -64.15 -40.03 87.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 51.06 110.562 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.42 -42.4 64.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.981 0.42 . . . . 20.12 109.952 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.546 ' O ' HD23 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -58.16 -40.24 80.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.842 -0.617 . . . . 224.53 109.672 179.647 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -67.63 -36.28 80.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 621.43 110.873 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.18 5.4 50.21 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.929 0.395 . . . . 30.77 110.207 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 16' ' ' ALA . 82.0 mttt 41.66 47.01 3.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.942 -0.572 . . . . 567.58 110.73 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.425 ' O ' ' OG ' ' A' ' 22' ' ' SER . 16.8 t -69.61 -80.07 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.888 -0.597 . . . . 66.44 110.739 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.425 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 1.8 m 167.01 131.68 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.041 -0.527 . . . . 124.63 110.097 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.2 m -57.36 -28.69 63.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.202 -0.454 . . . . 161.57 110.929 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.16 -40.87 29.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.819 0.342 . . . . 33.36 111.135 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.3 p -57.6 -64.69 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.161 -0.472 . . . . 27.44 110.048 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.5 p -54.48 -31.94 23.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.377 -0.374 . . . . 159.62 111.093 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.2 t -73.65 -36.7 65.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.342 -0.39 . . . . 155.36 111.071 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -82.2 -19.42 39.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.991 0.425 . . . . 775.5 110.365 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.29 -19.8 5.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.828 -0.624 . . . . 85.13 111.153 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.2 mt -88.09 -9.6 52.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.709 0.29 . . . . 569.51 110.862 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 7.5 mmt -115.99 -38.39 3.65 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.46 -0.336 . . . . 306.42 110.735 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -155.89 87.1 3.08 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 364.5 110.479 -179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.83 73.15 6.15 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 122.162 1.908 . . . . 203.0 112.075 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -155.05 26.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.955 -0.566 . . . . 999.99 110.426 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -111.89 -19.99 12.19 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.128 -0.487 . . . . 999.99 110.135 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.1 t -65.97 143.17 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.055 -0.52 . . . . 152.7 110.432 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.538 ' O ' ' N ' ' A' ' 41' ' ' ARG . 5.6 t -61.16 145.44 51.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 183.1 110.32 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -47.71 -52.23 19.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.164 -0.471 . . . . 606.51 110.966 -179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.87 -52.87 62.38 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.229 -0.589 . . . . 41.5 110.229 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 72.1 m -65.17 -22.36 66.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.16 -0.473 . . . . 57.18 110.896 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 37' ' ' SER . 63.0 ttt180 -71.23 -41.34 70.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 885.64 110.846 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -68.14 -32.02 72.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.897 0.379 . . . . 378.75 110.762 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.6 mtp180 -69.39 -46.01 67.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.099 -0.5 . . . . 499.14 109.983 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.68 -50.73 78.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.941 -0.572 . . . . 164.42 110.235 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -50.57 -50.53 53.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.254 -0.43 . . . . 357.45 110.829 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -70.21 -34.97 73.56 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.887 -0.325 . . . . 678.15 110.561 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.61 -22.08 61.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.438 . . . . 54.05 110.53 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.36 -46.37 88.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.442 . . . . 40.59 110.534 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -75.78 -34.58 60.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 999.99 110.881 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -59.49 -45.83 90.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.362 -0.381 . . . . 396.77 111.326 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.5 p -75.35 -16.7 15.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 C-N-CA 120.853 -0.339 . . . . 199.31 110.723 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.685 0 N-CA-C 111.474 -0.65 . . . . 130.71 111.474 179.443 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.417 ' HB3' HG13 ' A' ' 51' ' ' VAL . . . -83.72 178.83 7.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.471 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.446 HG22 ' H ' ' A' ' 13' ' ' LYS . 24.8 m -143.55 148.69 36.33 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.361 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 10.5 ptt? -53.62 -27.26 26.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.708 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.446 ' H ' HG22 ' A' ' 11' ' ' THR . 32.4 ttmt -72.54 -41.88 65.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.662 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -63.07 -34.74 78.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.479 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.409 ' CG2' HG21 ' A' ' 51' ' ' VAL . 54.3 t -64.59 -37.44 80.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.589 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.55 -46.18 66.69 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.007 0.432 . . . . 0.0 110.006 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.4 mt -66.98 -39.35 87.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.306 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -65.02 -32.47 74.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.983 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -105.39 12.7 31.28 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.76 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt 35.46 47.9 0.38 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.319 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.429 ' O ' ' OG ' ' A' ' 22' ' ' SER . 11.4 t -69.03 -79.99 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.814 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 1.6 m 167.09 129.9 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.267 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 6.2 t -51.55 -29.7 17.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.972 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.55 -41.23 27.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.864 0.364 . . . . 0.0 111.227 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.41 ' OG1' HG12 ' A' ' 21' ' ' VAL . 15.8 p -57.68 -64.88 0.75 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.85 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.4 p -50.87 -34.68 13.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.721 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.9 t -76.63 -32.52 58.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.78 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 31' ' ' MET . 52.4 mmt-85 -82.45 -19.54 38.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.131 0.491 . . . . 0.0 110.103 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.79 -20.04 0.44 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.005 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 pp -102.61 -16.04 16.19 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.718 0.294 . . . . 0.0 110.484 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.409 ' N ' ' O ' ' A' ' 28' ' ' ARG . 41.6 mtt -100.28 -53.5 3.1 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.476 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -143.97 83.37 10.37 Favored Pre-proline 0 N--CA 1.464 0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.347 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -80.93 63.06 8.74 Favored 'Trans proline' 0 C--N 1.312 -1.384 0 C-N-CA 122.278 1.986 . . . . 0.0 112.039 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -154.85 34.69 0.4 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.433 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -124.32 -14.73 6.89 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.31 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 97.2 t -65.88 144.56 14.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.066 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.519 ' O ' ' N ' ' A' ' 41' ' ' ARG . 5.6 t -59.6 144.9 46.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.163 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -47.7 -53.85 13.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.637 -179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.06 -53.15 61.15 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.364 -0.534 . . . . 0.0 109.812 -179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 86.5 m -62.18 -24.7 67.35 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.836 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.519 ' N ' ' O ' ' A' ' 37' ' ' SER . 41.6 ttp180 -70.57 -42.84 70.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.673 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.0 t-20 -65.61 -33.67 76.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.729 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -68.71 -43.38 76.12 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.947 0.403 . . . . 0.0 110.254 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 47.4 t -58.37 -50.55 78.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.155 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -50.61 -50.08 54.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.613 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -70.24 -39.56 74.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.779 0.324 . . . . 0.0 110.672 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.7 -23.54 66.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.736 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.472 ' O ' ' N ' ' A' ' 52' ' ' GLY . . . -73.02 -38.35 66.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.782 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.9 ttp180 -68.27 -38.0 81.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.927 0.394 . . . . 0.0 110.362 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -59.4 -51.02 71.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.217 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.417 HG13 ' HB3' ' A' ' 10' ' ' ALA . 72.1 t -82.53 -24.45 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.698 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.472 ' N ' ' O ' ' A' ' 48' ' ' ALA . . . 42.35 38.45 2.82 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 112.132 -0.387 . . . . 0.0 112.132 179.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -140.73 114.71 9.08 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.898 0.349 . . . . 0.0 110.087 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.41 65.6 3.97 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.423 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo . . . . . 0 C--N 1.308 -1.582 0 C-N-CA 122.662 2.241 . . . . 0.0 112.142 179.955 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -100.06 168.01 10.11 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.313 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.4 m -143.66 148.96 36.55 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.226 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 11.5 tpt -48.26 -30.0 4.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.691 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -74.55 -42.01 59.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.693 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -62.0 -34.51 76.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.87 0.367 . . . . 0.0 110.588 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.5 t -62.03 -40.51 87.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.259 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.494 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.86 -41.77 64.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.409 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 53.6 tp -59.95 -42.86 94.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.322 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -63.89 -33.32 75.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.769 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.429 ' HB3' HG23 ' A' ' 21' ' ' VAL . . . -103.65 5.68 36.57 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.753 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 16' ' ' ALA . 65.9 mttm 41.41 46.98 3.04 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.078 0.466 . . . . 0.0 110.641 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.429 HG23 ' HB3' ' A' ' 19' ' ' ALA . 80.0 t -70.07 -81.87 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.137 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.431 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.5 t 171.36 129.74 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.335 -179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 35.6 m -62.92 -28.61 70.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.728 -179.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.65 -38.85 32.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.918 0.39 . . . . 0.0 111.253 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' A' ' 22' ' ' SER . 17.9 p -56.63 -64.48 0.86 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.838 -178.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.9 t -51.54 -25.52 5.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.2 p -77.15 -31.49 55.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.377 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' A' ' 32' ' ' ASN . 97.4 mtt180 -82.07 -19.48 40.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.217 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.46 -19.92 0.99 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.108 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.564 ' N ' HD12 ' A' ' 30' ' ' LEU . 9.7 mp -97.12 -12.28 23.32 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.564 0.221 . . . . 0.0 110.924 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 20.2 mmt -121.62 -52.08 2.03 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.803 0.335 . . . . 0.0 110.894 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 28' ' ' ARG . 9.6 t-20 -130.22 80.6 70.38 Favored Pre-proline 0 N--CA 1.466 0.339 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.382 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.99 61.61 7.88 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 C-N-CA 122.475 2.117 . . . . 0.0 112.298 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -161.68 44.53 0.16 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.622 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -127.18 -20.69 4.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.632 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.1 t -66.59 141.93 17.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.536 ' O ' ' N ' ' A' ' 41' ' ' ARG . 1.6 m -58.43 143.3 45.89 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.791 -179.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -47.48 -53.87 13.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.739 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.49 -52.26 66.4 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.805 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.457 ' O ' HG23 ' A' ' 44' ' ' VAL . 95.5 m -64.68 -22.01 66.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.887 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.536 ' N ' ' O ' ' A' ' 37' ' ' SER . 16.9 tpt180 -71.01 -42.21 69.88 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.614 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.536 ' N ' HD22 ' A' ' 42' ' ' ASN . 1.2 m-80 -68.76 -36.32 78.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.864 0.364 . . . . 0.0 110.765 -179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 45.3 ttm-85 -68.11 -44.14 76.85 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.107 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.511 ' O ' ' N ' ' A' ' 48' ' ' ALA . 37.2 t -58.88 -48.89 84.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.911 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 74.6 tt0 -50.11 -50.82 47.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.61 -179.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -70.3 -35.53 73.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.85 0.357 . . . . 0.0 110.576 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.81 -23.61 60.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.409 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -68.01 -39.2 83.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.61 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -71.87 -34.51 69.26 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.331 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -53.84 -50.71 65.61 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.546 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.538 HG13 ' H ' ' A' ' 53' ' ' TYR . 7.4 p -79.43 -8.24 11.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.535 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 52.37 28.61 28.34 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 111.647 -0.581 . . . . 0.0 111.647 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.538 ' H ' HG13 ' A' ' 51' ' ' VAL . 12.9 t80 -140.77 114.4 8.84 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.472 ' N ' ' CD ' ' A' ' 55' ' ' PRO . 0.6 OUTLIER -156.91 50.57 0.45 Allowed Pre-proline 0 C--N 1.332 -0.19 0 CA-C-O 120.793 0.33 . . . . 0.0 111.114 -179.776 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.472 ' CD ' ' N ' ' A' ' 54' ' ' LEU . 55.5 Cg_endo . . . . . 0 C--N 1.306 -1.66 0 C-N-CA 122.588 2.192 . . . . 0.0 111.829 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.511 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -90.03 179.72 5.88 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.464 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 13' ' ' LYS . 28.0 m -146.33 149.56 34.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.367 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 63.3 mtt -50.89 -25.27 4.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.481 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.424 ' H ' HG22 ' A' ' 11' ' ' THR . 35.9 ttpt -75.57 -43.25 49.47 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.951 -179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -62.35 -33.95 75.7 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.636 -179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.413 HG11 ' HB1' ' A' ' 47' ' ' ALA . 77.8 t -65.15 -37.39 80.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.591 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.36 -45.2 65.65 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.7 tp -54.09 -41.5 68.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.32 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -69.9 -42.83 72.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.028 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -80.61 -0.38 37.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.153 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp 42.91 33.43 0.5 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.974 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.436 HG23 ' H ' ' A' ' 22' ' ' SER . 0.0 OUTLIER -70.35 -74.56 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.131 -179.941 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.436 ' H ' HG23 ' A' ' 21' ' ' VAL . 2.0 t 172.35 139.37 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.352 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 12.8 m -67.66 -28.87 68.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.045 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.08 -38.31 44.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.977 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.0 p -57.62 -64.85 0.76 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.129 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.3 p -50.81 -27.67 5.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.191 -179.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.3 p -82.75 -34.78 27.05 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.047 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 83.0 mtt-85 -81.81 -30.48 32.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.853 0.358 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.495 ' C ' ' H ' ' A' ' 31' ' ' MET . . . -53.97 -54.91 32.42 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.615 -179.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 32.7 mt -49.77 -10.25 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.843 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.495 ' H ' ' C ' ' A' ' 29' ' ' ALA . 15.6 mmt -115.33 -36.16 4.41 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.857 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' A' ' 34' ' ' ASP . 25.6 m120 -156.01 81.94 3.68 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.822 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -63.33 54.62 0.16 Allowed 'Trans proline' 0 N--CA 1.501 1.928 0 C-N-CA 122.97 2.447 . . . . 0.0 112.451 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.445 ' N ' ' O ' ' A' ' 32' ' ' ASN . 19.6 t70 -122.94 -29.56 3.92 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.979 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -66.6 -23.55 66.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.755 0.312 . . . . 0.0 110.735 -179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.0 m -69.03 139.57 20.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.413 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.522 ' O ' ' N ' ' A' ' 41' ' ' ARG . 58.6 m -71.72 159.31 34.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.228 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -47.06 -58.61 3.83 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.224 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.83 -52.89 63.31 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.099 -0.64 . . . . 0.0 109.452 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.482 ' O ' HG23 ' A' ' 44' ' ' VAL . 53.4 m -58.52 -25.64 62.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.711 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 37' ' ' SER . 20.1 ttm180 -70.47 -39.32 74.31 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.874 0.369 . . . . 0.0 110.4 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -71.49 -45.55 62.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.942 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.6 ttm180 -63.43 -43.33 97.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.951 0.405 . . . . 0.0 110.067 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 40' ' ' THR . 25.1 t -60.18 -51.83 68.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.851 179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -51.0 -44.76 60.98 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.849 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 55.5 mttm -70.07 -38.26 75.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.669 0.271 . . . . 0.0 110.713 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.421 ' O ' HG12 ' A' ' 51' ' ' VAL . . . -57.42 -22.61 44.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.75 -179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.09 -44.74 79.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.834 0.35 . . . . 0.0 110.468 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -76.44 -43.6 39.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.964 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 60.1 tt0 -59.57 -42.71 93.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.702 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.421 HG12 ' O ' ' A' ' 47' ' ' ALA . 6.3 p -75.6 -22.83 16.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.849 -0.34 . . . . 0.0 110.964 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 48.44 56.97 8.71 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -79.52 115.79 19.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.973 0.416 . . . . 0.0 110.231 179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.702 ' H ' ' CD ' ' A' ' 55' ' ' PRO . 11.6 mt -115.57 -34.89 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.431 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.605 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.702 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 53.1 Cg_exo . . . . . 0 N--CA 1.496 1.652 0 C-N-CA 121.888 1.725 . . . . 0.0 112.122 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -104.34 83.73 2.1 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.405 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.3 p -57.79 155.52 10.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.365 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.506 ' SD ' ' CD2' ' A' ' 53' ' ' TYR . 70.4 mtp -48.86 -24.69 1.54 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.203 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.45 ' CB ' ' NZ ' ' A' ' 13' ' ' LYS . 8.5 mtmp? -72.44 -42.97 64.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.461 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -57.61 -38.37 74.82 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.821 0.343 . . . . 0.0 110.394 -179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.53 -47.05 89.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.408 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.46 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.58 -29.92 28.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.405 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.518 ' O ' HD23 ' A' ' 17' ' ' LEU . 0.9 OUTLIER -64.82 -48.08 75.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.055 179.977 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -71.3 -37.77 71.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.08 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.401 ' HB3' HG23 ' A' ' 21' ' ' VAL . . . -88.84 -1.8 58.27 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.864 0.364 . . . . 0.0 110.434 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.46 ' N ' ' O ' ' A' ' 16' ' ' ALA . 40.7 mtmt 43.32 47.25 5.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.705 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.429 ' O ' ' CB ' ' A' ' 22' ' ' SER . 30.2 t -70.05 -79.54 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.662 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.442 ' OG ' ' CG2' ' A' ' 25' ' ' THR . 1.0 OUTLIER 165.78 134.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.111 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.6 m -60.88 -27.87 68.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.425 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.71 -40.93 39.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.836 0.35 . . . . 0.0 111.073 -179.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.442 ' CG2' ' OG ' ' A' ' 22' ' ' SER . 12.3 p -58.33 -65.53 0.64 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.926 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.9 p -53.73 -33.91 23.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.997 -179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.8 t -75.02 -37.1 61.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.682 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.3 mmt85 -82.46 -20.43 36.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.287 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -70.96 -20.5 62.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.896 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.7 mt -61.61 -25.58 67.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.72 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 67.3 mtm -122.35 -14.59 7.84 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.852 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -151.69 82.23 5.65 Favored Pre-proline 0 N--CA 1.464 0.25 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.638 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -79.9 73.92 5.79 Favored 'Trans proline' 0 N--CA 1.492 1.427 0 C-N-CA 122.203 1.935 . . . . 0.0 112.123 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -160.6 28.99 0.16 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.52 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -106.6 -23.19 12.53 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.422 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.456 HG22 ' H ' ' A' ' 36' ' ' VAL . 2.6 m -65.75 145.59 13.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.943 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.566 ' O ' ' N ' ' A' ' 41' ' ' ARG . 16.1 t -64.22 153.66 37.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.141 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.558 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 3.1 mp0 -46.81 -56.43 6.27 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.851 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.39 -51.9 67.92 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 119.944 -0.703 . . . . 0.0 109.654 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.43 ' O ' HG13 ' A' ' 44' ' ' VAL . 97.2 m -63.06 -21.81 66.42 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.248 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.566 ' N ' ' O ' ' A' ' 37' ' ' SER . 32.9 ttp180 -71.45 -37.38 71.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.906 0.384 . . . . 0.0 110.967 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -74.56 -39.18 62.43 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.063 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -64.34 -48.1 76.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.024 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.48 HG23 ' N ' ' A' ' 45' ' ' GLU . 34.1 m -62.2 -45.13 99.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.042 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.48 ' N ' HG23 ' A' ' 44' ' ' VAL . 32.8 tt0 -51.04 -50.64 58.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.88 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.1 mmtp -71.62 -33.77 69.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.851 0.358 . . . . 0.0 111.108 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.32 -21.81 61.27 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.074 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.15 -37.86 72.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.803 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -72.65 -38.72 67.58 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.432 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -54.72 -45.78 74.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.742 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.3 m -75.78 -0.8 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.646 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 45.0 52.03 8.18 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 111.174 -0.771 . . . . 0.0 111.174 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.506 ' CD2' ' SD ' ' A' ' 12' ' ' MET . 77.5 t80 -82.29 129.67 34.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.764 0.316 . . . . 0.0 110.409 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.2 mt -132.31 151.53 78.48 Favored Pre-proline 0 CA--C 1.534 0.352 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.013 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo . . . . . 0 N--CA 1.494 1.533 0 C-N-CA 122.171 1.914 . . . . 0.0 111.868 179.935 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -115.77 82.93 1.85 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.335 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.3 p -61.01 168.81 2.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.398 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 27.3 ttt -57.09 -24.81 56.68 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.279 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -68.4 -40.33 81.33 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.193 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -63.3 -36.98 85.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.49 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 92.9 t -58.27 -45.18 89.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.748 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.73 -40.24 62.85 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.989 0.423 . . . . 0.0 110.401 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 7.2 tp -56.55 -45.76 81.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.8 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -69.01 -33.94 74.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.293 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.14 -1.39 57.75 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.696 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 46.12 45.61 12.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.977 0.417 . . . . 0.0 110.64 179.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.41 ' O ' ' CB ' ' A' ' 22' ' ' SER . 21.6 t -69.61 -78.11 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.089 -179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.41 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.5 t 165.92 136.79 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.422 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.0 m -61.75 -28.07 69.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.067 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -77.86 -39.84 42.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.819 0.342 . . . . 0.0 111.067 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.403 ' OG1' ' O ' ' A' ' 22' ' ' SER . 19.9 p -57.66 -65.13 0.68 Allowed 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.791 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.9 p -52.3 -31.4 14.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.784 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.5 t -76.2 -36.13 58.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.724 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.3 mmm180 -79.36 -19.46 50.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.019 0.438 . . . . 0.0 110.276 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -72.01 -20.04 61.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.693 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 23.7 mt -63.25 -22.31 66.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.403 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 8.3 ptp -121.59 -13.1 8.42 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.581 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -152.24 68.6 7.28 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.505 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -81.66 161.56 19.12 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 122.895 2.396 . . . . 0.0 112.337 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 78.38 25.38 0.58 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.473 -179.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -127.07 17.66 7.2 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.319 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 17.4 m -77.02 162.63 4.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.492 ' O ' ' N ' ' A' ' 41' ' ' ARG . 40.9 t -46.13 146.46 1.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.903 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.428 ' CG ' ' N ' ' A' ' 39' ' ' ALA . 14.7 pt20 -47.49 -44.95 25.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.604 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.428 ' N ' ' CG ' ' A' ' 38' ' ' GLN . . . -63.02 -52.93 60.98 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.093 -0.643 . . . . 0.0 109.446 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 85.2 m -64.44 -22.55 66.99 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.618 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 37' ' ' SER . 33.5 ttt85 -70.05 -44.9 68.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.032 0.444 . . . . 0.0 110.183 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.9 m-20 -74.54 -43.67 54.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.875 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 63.1 mtp180 -65.8 -43.56 88.34 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.607 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.3 p -65.05 -41.24 91.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 119.842 -0.743 . . . . 0.0 110.327 -179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -51.26 -50.69 58.73 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.558 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -71.58 -35.48 70.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.838 0.352 . . . . 0.0 111.068 179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -67.18 -21.21 65.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.21 -179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.03 -47.35 59.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.869 0.366 . . . . 0.0 110.494 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -74.0 -41.7 61.5 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.922 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -60.61 -50.51 73.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.851 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 51' ' ' VAL . 45.4 t -76.41 -6.45 8.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-O 121.026 0.441 . . . . 0.0 110.334 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.77 52.87 50.39 Favored Glycine 0 CA--C 1.526 0.741 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.625 179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 93.5 t80 -93.32 130.39 39.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 120.777 0.322 . . . . 0.0 110.328 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.7 mt -131.5 152.22 80.09 Favored Pre-proline 0 N--CA 1.467 0.375 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.831 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo . . . . . 0 N--CA 1.496 1.652 0 C-N-CA 122.148 1.899 . . . . 0.0 111.845 179.841 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.405 ' HB3' HG23 ' A' ' 51' ' ' VAL . . . -84.41 157.83 21.28 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.528 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.0 p -143.58 146.96 33.72 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.971 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 14.1 ptm -47.95 -26.25 1.67 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.917 0.389 . . . . 0.0 110.417 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -78.66 -47.26 17.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.568 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -57.61 -36.69 72.12 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 120.872 0.367 . . . . 0.0 110.555 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.6 t -58.42 -45.13 89.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.592 -179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.73 -41.2 63.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.753 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 15.7 mt -76.06 -45.27 35.03 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.588 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.55 -42.97 84.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.876 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -100.96 16.65 24.59 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.672 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.9 pttm 35.88 47.74 0.44 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.104 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.401 ' O ' ' CB ' ' A' ' 22' ' ' SER . 17.2 t -68.67 -78.01 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.593 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.401 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.4 t 168.58 138.84 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.496 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 26.1 m -68.29 -28.04 66.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.818 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.9 -43.8 24.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.837 179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.441 ' O ' ' N ' ' A' ' 29' ' ' ALA . 53.0 p -58.21 -65.04 0.71 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.144 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p -50.95 -29.37 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.069 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.6 m -82.08 -36.94 27.09 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.751 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.9 mmt180 -82.78 -19.58 37.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.282 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.441 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -48.87 -53.63 18.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.597 -179.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.02 -10.02 57.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.073 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 41.1 mtp -94.17 -52.09 4.53 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.041 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -160.83 86.9 1.76 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.753 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -47.7 107.09 0.12 Allowed 'Trans proline' 0 N--CA 1.494 1.54 0 C-N-CA 122.404 2.069 . . . . 0.0 111.894 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.495 ' C ' ' H ' ' A' ' 36' ' ' VAL . 29.4 t70 -176.74 -31.22 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.569 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.2 mmmm -66.12 11.37 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 121.188 -0.205 . . . . 0.0 111.51 -178.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.495 ' H ' ' C ' ' A' ' 34' ' ' ASP . 3.5 m -107.38 127.93 62.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.541 ' O ' ' N ' ' A' ' 41' ' ' ARG . 39.6 t -72.42 164.59 26.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.534 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -47.6 -54.92 10.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.329 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.33 -53.35 59.27 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.174 -0.611 . . . . 0.0 109.575 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.454 ' O ' HG23 ' A' ' 44' ' ' VAL . 52.0 m -62.2 -23.26 66.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.045 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.541 ' N ' ' O ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -71.26 -44.78 64.6 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.296 -179.961 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -70.02 -42.68 72.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.12 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 71.3 mtp85 -65.36 -45.36 84.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 110.252 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 28.0 t -60.15 -48.13 89.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.054 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -51.14 -51.67 51.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.739 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -70.23 -39.94 74.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.798 0.333 . . . . 0.0 110.87 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.95 -23.05 61.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.889 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.58 -39.36 64.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.919 179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.6 ttp180 -69.85 -35.26 74.59 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.027 -179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -55.88 -49.86 72.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.47 -179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.497 HG22 ' O ' ' A' ' 51' ' ' VAL . 7.9 p -75.42 -7.16 9.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.782 -179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 79.77 -31.19 2.24 Favored Glycine 0 CA--C 1.522 0.526 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 179.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -80.65 114.79 19.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.8 mt -103.57 148.6 36.0 Favored Pre-proline 0 CA--C 1.533 0.322 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo . . . . . 0 N--CA 1.494 1.51 0 C-N-CA 121.977 1.785 . . . . 0.0 111.955 179.92 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.06 174.29 11.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.431 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.0 p -140.65 145.45 36.61 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.159 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 22.4 ttt -59.87 -25.17 64.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.633 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.9 ttmm -71.78 -46.73 57.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.208 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -61.93 -33.02 73.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.423 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 52.4 t -61.47 -45.98 97.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.612 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.54 -37.47 57.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.528 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.517 ' O ' HD23 ' A' ' 17' ' ' LEU . 0.9 OUTLIER -62.94 -46.35 88.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.022 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.2 tttp -66.54 -33.96 76.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.038 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.419 ' HB3' HG23 ' A' ' 21' ' ' VAL . . . -93.64 5.9 50.08 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.381 -179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 30.5 ttmt 41.2 45.35 2.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.993 0.425 . . . . 0.0 110.669 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.436 ' O ' ' CB ' ' A' ' 22' ' ' SER . 21.2 t -69.46 -78.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.795 -179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.436 ' CB ' ' O ' ' A' ' 21' ' ' VAL . 1.6 m 165.87 136.69 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.139 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 7.6 p -64.65 -28.44 69.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.0 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.03 -40.99 29.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.058 0.456 . . . . 0.0 110.706 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.6 p -57.15 -64.25 0.94 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.165 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p -50.15 -27.02 3.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.825 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.7 m -80.13 -32.06 38.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.55 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -82.09 -19.37 40.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.179 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.17 -19.47 64.0 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.58 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.2 mt -86.63 -15.63 39.13 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.204 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.1 mmt -100.31 -32.2 10.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.416 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -160.18 147.42 12.5 Favored Pre-proline 0 CA--C 1.535 0.373 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.435 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.53 -45.12 0.13 Allowed 'Trans proline' 0 N--CA 1.495 1.601 0 C-N-CA 122.257 1.971 . . . . 0.0 112.253 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -69.65 55.41 0.12 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.42 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -127.41 -5.8 5.92 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 120.902 0.382 . . . . 0.0 110.303 179.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 6.1 m -104.52 142.79 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.282 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.525 ' O ' ' N ' ' A' ' 41' ' ' ARG . 39.6 m -66.01 160.01 24.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.168 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.64 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 0.5 OUTLIER -47.42 -48.49 26.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.41 -179.427 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.43 -53.16 56.64 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.221 -0.592 . . . . 0.0 109.643 179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.7 m -62.3 -22.88 66.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.774 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.525 ' N ' ' O ' ' A' ' 37' ' ' SER . 56.9 ttt180 -71.46 -44.2 65.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.613 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -72.32 -42.78 65.03 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.465 -179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -65.12 -45.06 86.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.836 0.351 . . . . 0.0 110.591 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 25.4 t -60.79 -45.57 97.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.987 179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -50.95 -52.52 41.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.68 -179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -71.69 -38.07 70.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.726 0.298 . . . . 0.0 111.071 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.61 -22.21 61.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.92 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.15 -42.8 62.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.447 ' CA ' ' HE ' ' A' ' 49' ' ' ARG . 0.0 OUTLIER -64.74 -34.78 79.12 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.313 179.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -53.49 -50.45 65.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.189 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.525 ' O ' HG12 ' A' ' 51' ' ' VAL . 61.4 t -90.95 -3.35 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.111 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 44.67 40.29 6.45 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 111.624 -0.59 . . . . 0.0 111.624 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -140.26 115.49 9.87 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.675 0.274 . . . . 0.0 110.669 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.617 ' H ' ' CD ' ' A' ' 55' ' ' PRO . 5.5 mt -108.68 -34.74 0.16 Allowed Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.178 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.617 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 52.1 Cg_exo . . . . . 0 N--CA 1.496 1.654 0 C-N-CA 121.877 1.718 . . . . 0.0 112.032 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -87.34 173.49 9.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.499 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.5 p -140.83 146.41 37.54 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.175 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.592 ' SD ' ' CD2' ' A' ' 53' ' ' TYR . 27.2 mtm -56.9 -24.86 55.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.6 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 53.2 mttm -71.88 -41.62 67.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.889 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -66.28 -37.51 85.61 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.046 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 74.9 t -67.25 -32.63 58.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.476 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.59 -46.53 66.97 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.548 -0.461 . . . . 0.0 109.813 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.0 mt -60.78 -33.04 72.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.984 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -63.39 -33.54 75.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.33 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.08 7.23 38.91 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.358 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.456 ' CB ' ' NZ ' ' A' ' 20' ' ' LYS . 7.8 mtpm? 42.97 49.12 5.22 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.615 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.0 t -72.49 -81.52 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.695 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.8 m 168.28 131.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.959 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 4.1 p -56.26 -28.88 60.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.0 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.63 -40.72 28.6 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.165 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.4 p -57.3 -64.34 0.92 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.177 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.3 p -50.55 -31.23 8.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.891 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.0 m -73.19 -29.62 62.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.854 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 32' ' ' ASN . 58.7 mtp85 -78.16 -19.31 54.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.95 0.405 . . . . 0.0 110.563 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.476 ' C ' HD12 ' A' ' 30' ' ' LEU . . . -48.58 -20.37 0.44 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.754 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.476 HD12 ' C ' ' A' ' 29' ' ' ALA . 9.1 mp -103.71 -26.17 12.86 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.37 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.406 ' O ' ' CG ' ' A' ' 32' ' ' ASN . 59.8 mmm -95.63 -56.76 2.58 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.479 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.409 ' N ' ' O ' ' A' ' 28' ' ' ARG . 3.5 m120 -178.71 93.82 0.22 Allowed Pre-proline 0 CA--C 1.54 0.585 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -81.56 86.42 1.59 Allowed 'Trans proline' 0 N--CA 1.492 1.413 0 C-N-CA 121.923 1.749 . . . . 0.0 112.113 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -113.21 -16.96 12.46 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.638 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.532 ' CD ' ' N ' ' A' ' 35' ' ' LYS . 9.6 mptt -82.84 -15.54 51.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.364 -179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.3 t -71.69 127.43 33.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.438 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.465 ' O ' ' N ' ' A' ' 41' ' ' ARG . 9.6 t -63.87 147.8 51.01 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.453 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.581 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 1.9 mp0 -47.19 -53.77 12.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.849 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.38 -52.67 64.26 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.877 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.0 m -60.49 -26.41 66.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.599 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.465 ' N ' ' O ' ' A' ' 37' ' ' SER . 37.1 ttt85 -70.51 -39.07 74.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.728 -179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.9 m120 -66.04 -33.68 76.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.6 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 65.0 mtm180 -68.24 -40.43 82.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.211 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.98 -52.15 64.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.064 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -50.74 -43.63 58.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.572 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -69.95 -38.8 76.26 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.831 0.348 . . . . 0.0 110.702 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.415 ' O ' HG12 ' A' ' 51' ' ' VAL . . . -57.74 -22.06 44.66 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.68 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.79 -46.01 63.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.009 0.433 . . . . 0.0 110.567 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 46.1 mtp85 -76.47 -34.56 58.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.943 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -72.16 -39.31 68.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.649 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.415 HG12 ' O ' ' A' ' 47' ' ' ALA . 5.8 p -75.28 -23.68 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 C-N-CA 120.781 -0.368 . . . . 0.0 110.995 -179.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 82.56 43.01 8.07 Favored Glycine 0 CA--C 1.526 0.751 0 N-CA-C 111.387 -0.685 . . . . 0.0 111.387 179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.592 ' CD2' ' SD ' ' A' ' 12' ' ' MET . 76.8 t80 -94.42 122.16 36.71 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 12.2 mt -114.23 150.83 44.32 Favored Pre-proline 0 N--CA 1.468 0.442 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.079 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo . . . . . 0 N--CA 1.495 1.563 0 C-N-CA 122.11 1.873 . . . . 0.0 111.808 179.946 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.11 -175.79 3.8 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.454 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.462 HG22 ' H ' ' A' ' 13' ' ' LYS . 22.1 m -142.63 145.69 33.74 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.104 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 13.9 ptt? -54.49 -26.25 30.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.577 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.462 ' H ' HG22 ' A' ' 11' ' ' THR . 29.7 ttpt -71.23 -36.85 71.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.692 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -69.95 -34.5 73.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.963 -179.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.1 t -64.88 -37.08 79.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.613 -0.435 . . . . 0.0 109.951 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.446 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.87 -45.68 67.55 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.1 tp -49.89 -38.44 35.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.949 179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -68.12 -38.73 82.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.631 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.11 2.35 56.4 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.179 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.446 ' N ' ' O ' ' A' ' 16' ' ' ALA . 49.9 mttp 45.15 53.41 7.9 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.576 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 92.4 t -85.83 -83.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.806 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 2.9 m 174.84 134.02 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.118 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 10.3 p -69.0 -28.28 66.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.115 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.23 -39.11 41.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.847 0.356 . . . . 0.0 110.966 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.0 p -57.63 -64.8 0.77 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.078 -178.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 28.1 t -59.56 -27.08 36.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.831 -179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.9 t -76.65 -39.96 50.61 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.864 -0.335 . . . . 0.0 110.626 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.3 mtt-85 -82.63 -26.75 31.93 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.935 0.398 . . . . 0.0 110.358 179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.473 ' C ' ' H ' ' A' ' 31' ' ' MET . . . -48.43 -47.79 37.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.834 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -56.91 -5.25 0.22 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.253 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.473 ' H ' ' C ' ' A' ' 29' ' ' ALA . 41.0 mtt -121.96 -41.49 2.44 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.883 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -157.27 88.09 2.61 Favored Pre-proline 0 CA--C 1.533 0.298 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.642 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -83.1 69.06 7.23 Favored 'Trans proline' 0 N--CA 1.491 1.348 0 C-N-CA 122.275 1.983 . . . . 0.0 112.077 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -119.1 -22.74 7.08 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.044 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.7 mmmt -77.73 -24.45 49.09 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.746 0.307 . . . . 0.0 110.786 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.83 135.93 27.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.29 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.554 ' O ' ' N ' ' A' ' 41' ' ' ARG . 10.6 t -67.83 151.95 46.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.272 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.613 ' H ' ' CD ' ' A' ' 38' ' ' GLN . 23.1 mp0 -47.68 -55.48 9.37 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.813 -179.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.54 -52.68 64.13 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.106 -0.638 . . . . 0.0 109.533 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.424 ' O ' HG13 ' A' ' 44' ' ' VAL . 65.0 m -60.44 -24.58 65.32 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.933 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.554 ' N ' ' O ' ' A' ' 37' ' ' SER . 30.8 ttp180 -71.28 -35.51 71.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.71 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 57.0 t30 -74.69 -41.21 60.66 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.971 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 44.9 ttt85 -62.46 -47.71 82.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.135 -179.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.474 HG23 ' N ' ' A' ' 45' ' ' GLU . 33.7 m -62.97 -45.07 99.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.18 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.474 ' N ' HG23 ' A' ' 44' ' ' VAL . 37.4 tt0 -50.56 -46.76 57.8 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.437 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -70.25 -34.96 73.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.807 0.337 . . . . 0.0 110.682 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.445 ' O ' HG12 ' A' ' 51' ' ' VAL . . . -58.59 -21.97 54.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.784 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -72.19 -41.57 66.83 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.876 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -75.32 -36.64 61.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.14 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -69.82 -42.08 74.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.163 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 47' ' ' ALA . 8.7 p -75.82 -21.11 15.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.787 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 45.94 56.53 6.7 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 111.066 -0.814 . . . . 0.0 111.066 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -76.48 122.08 24.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.775 0.322 . . . . 0.0 110.376 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.1 mt -137.91 152.02 71.4 Favored Pre-proline 0 N--CA 1.465 0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.081 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo . . . . . 0 N--CA 1.494 1.514 0 C-N-CA 122.278 1.985 . . . . 0.0 111.879 179.878 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -95.57 114.78 26.57 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.389 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.413 ' OG1' ' OD2' ' A' ' 14' ' ' ASP . 8.5 p -63.81 153.28 37.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.52 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 25.0 ttt -51.98 -24.88 7.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.327 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.9 mttp -70.63 -44.02 68.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.232 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' OD2' ' OG1' ' A' ' 11' ' ' THR . 36.1 m-20 -56.45 -37.56 70.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.259 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 47.5 t -58.4 -48.36 85.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.104 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.9 -29.48 28.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.673 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.511 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -67.07 -50.55 61.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.495 -179.649 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -76.06 -48.23 21.61 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.094 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.59 -4.98 25.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.663 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 71.9 tttt 42.62 47.06 4.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.487 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.459 HG12 ' OG1' ' A' ' 25' ' ' THR . 19.2 t -69.14 -79.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.278 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.419 ' O ' ' OG1' ' A' ' 25' ' ' THR . 1.6 m 165.66 134.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.245 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.9 m -57.11 -28.54 62.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.629 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -78.94 -41.47 29.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.865 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.459 ' OG1' HG12 ' A' ' 21' ' ' VAL . 15.1 p -57.88 -65.15 0.69 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.847 -179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.4 p -51.37 -33.22 13.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.863 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 39.9 t -78.17 -35.49 48.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.017 -179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 33.3 mmt180 -83.28 -20.17 34.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.085 0.469 . . . . 0.0 110.138 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.449 ' N ' ' O ' ' A' ' 25' ' ' THR . . . -54.6 -19.56 6.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.394 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.541 ' N ' HD12 ' A' ' 30' ' ' LEU . 10.1 mp -88.55 -5.95 57.87 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.635 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 21.3 mmt -121.45 -39.5 2.66 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.844 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -153.95 81.18 4.77 Favored Pre-proline 0 C--N 1.331 -0.206 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.634 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -81.55 76.59 4.3 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 C-N-CA 122.379 2.052 . . . . 0.0 111.965 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -158.94 29.25 0.21 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.488 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -121.06 -6.9 9.47 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.608 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.4 t -65.99 133.42 30.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.272 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.542 ' O ' ' N ' ' A' ' 41' ' ' ARG . 1.8 m -50.36 140.35 13.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.319 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -46.92 -53.61 11.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.609 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.31 -52.1 65.79 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.232 -0.587 . . . . 0.0 109.442 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.463 ' O ' HG23 ' A' ' 44' ' ' VAL . 88.1 m -65.19 -22.02 66.84 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.762 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.542 ' N ' ' O ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -70.64 -45.61 64.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.953 0.406 . . . . 0.0 110.249 179.685 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -67.53 -35.87 79.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.917 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 51.8 mtm180 -68.32 -34.89 76.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.584 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 48' ' ' ALA . 24.8 t -67.46 -45.95 84.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -51.09 -55.63 16.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.147 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -71.38 -37.61 71.58 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.328 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -72.38 -22.03 61.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.1 -179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.5 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -72.84 -43.32 62.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.727 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.0 tpt180 -67.34 -34.62 77.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.575 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -60.07 -48.93 79.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.631 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.7 m -75.73 -8.87 12.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.587 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 49.76 53.75 20.41 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -80.67 133.97 35.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.779 0.323 . . . . 0.0 110.39 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.2 mt -136.94 151.59 72.49 Favored Pre-proline 0 N--CA 1.465 0.321 0 CA-C-N 116.167 -0.47 . . . . 0.0 109.999 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo . . . . . 0 N--CA 1.495 1.565 0 C-N-CA 122.21 1.94 . . . . 0.0 111.876 179.919 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.406 -0.591 . . . . 283.33 109.406 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -101.56 -172.62 2.19 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.116 -0.493 . . . . 150.8 110.343 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.408 ' OG1' ' OD2' ' A' ' 14' ' ' ASP . 7.7 p -145.67 153.4 40.97 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.258 -0.428 . . . . 140.57 110.053 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 3.2 mtp -52.48 -26.28 12.48 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.679 -0.489 . . . . 647.38 109.679 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.7 ttmt -71.64 -40.41 69.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.08 -0.509 . . . . 414.97 110.568 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.408 ' OD2' ' OG1' ' A' ' 11' ' ' THR . 54.2 m-20 -64.41 -33.76 76.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.324 -0.398 . . . . 336.18 110.471 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.4 t -64.15 -40.03 87.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.298 -0.41 . . . . 51.06 110.562 -179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.482 ' O ' ' N ' ' A' ' 20' ' ' LYS . . . -52.42 -42.4 64.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.981 0.42 . . . . 20.12 109.952 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.546 ' O ' HD23 ' A' ' 17' ' ' LEU . 0.8 OUTLIER -58.16 -40.24 80.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.842 -0.617 . . . . 224.53 109.672 179.647 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.0 ttmm -67.63 -36.28 80.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 621.43 110.873 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.18 5.4 50.21 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.929 0.395 . . . . 30.77 110.207 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' A' ' 16' ' ' ALA . 82.0 mttt 41.66 47.01 3.33 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.942 -0.572 . . . . 567.58 110.73 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.425 ' O ' ' OG ' ' A' ' 22' ' ' SER . 16.8 t -69.61 -80.07 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.888 -0.597 . . . . 66.44 110.739 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.425 ' OG ' ' O ' ' A' ' 21' ' ' VAL . 1.8 m 167.01 131.68 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.041 -0.527 . . . . 124.63 110.097 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 9.2 m -57.36 -28.69 63.38 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.202 -0.454 . . . . 161.57 110.929 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -79.16 -40.87 29.82 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.819 0.342 . . . . 33.36 111.135 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.3 p -57.6 -64.69 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.161 -0.472 . . . . 27.44 110.048 -179.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.5 p -54.48 -31.94 23.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.377 -0.374 . . . . 159.62 111.093 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.2 t -73.65 -36.7 65.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.342 -0.39 . . . . 155.36 111.071 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -82.2 -19.42 39.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.991 0.425 . . . . 775.5 110.365 179.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.29 -19.8 5.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.828 -0.624 . . . . 85.13 111.153 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.2 mt -88.09 -9.6 52.78 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.709 0.29 . . . . 569.51 110.862 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 7.5 mmt -115.99 -38.39 3.65 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.46 -0.336 . . . . 306.42 110.735 -179.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -155.89 87.1 3.08 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 364.5 110.479 -179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.83 73.15 6.15 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 122.162 1.908 . . . . 203.0 112.075 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -155.05 26.27 0.42 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.955 -0.566 . . . . 999.99 110.426 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -111.89 -19.99 12.19 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.128 -0.487 . . . . 999.99 110.135 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.1 t -65.97 143.17 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.055 -0.52 . . . . 152.7 110.432 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.538 ' O ' ' N ' ' A' ' 41' ' ' ARG . 5.6 t -61.16 145.44 51.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 183.1 110.32 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -47.71 -52.23 19.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.164 -0.471 . . . . 606.51 110.966 -179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.87 -52.87 62.38 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.229 -0.589 . . . . 41.5 110.229 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 72.1 m -65.17 -22.36 66.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.16 -0.473 . . . . 57.18 110.896 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.538 ' N ' ' O ' ' A' ' 37' ' ' SER . 63.0 ttt180 -71.23 -41.34 70.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 885.64 110.846 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.4 t30 -68.14 -32.02 72.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.897 0.379 . . . . 378.75 110.762 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 40.6 mtp180 -69.39 -46.01 67.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.099 -0.5 . . . . 499.14 109.983 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.68 -50.73 78.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.941 -0.572 . . . . 164.42 110.235 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -50.57 -50.53 53.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.254 -0.43 . . . . 357.45 110.829 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -70.21 -34.97 73.56 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.887 -0.325 . . . . 678.15 110.561 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.61 -22.08 61.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.438 . . . . 54.05 110.53 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.36 -46.37 88.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.442 . . . . 40.59 110.534 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.9 ttp180 -75.78 -34.58 60.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 999.99 110.881 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -59.49 -45.83 90.56 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.362 -0.381 . . . . 396.77 111.326 -179.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.5 p -75.35 -16.7 15.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 C-N-CA 120.853 -0.339 . . . . 199.31 110.723 -179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 58.71 53.82 43.04 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 111.474 -0.65 . . . . 130.71 111.474 179.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -107.63 149.01 28.58 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.766 0.317 . . . . 613.1 110.259 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.3 mt -140.08 152.05 66.51 Favored Pre-proline 0 N--CA 1.466 0.344 0 CA-C-N 116.218 -0.446 . . . . 999.99 109.974 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo . . . . . 0 N--CA 1.495 1.559 0 C-N-CA 122.148 1.899 . . . . 999.99 111.891 179.944 . . . . . . . . 0 0 . 1 stop_ save_