data_2k7r_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 2k7r _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 ' 16' ' ' ASP . . . . . 0.611 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 22.0 t70 . . . . . 0 N--CA 1.462 0.133 0 CA-C-O 121.223 0.535 . . . . 0.0 109.984 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -52.78 -41.32 64.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.475 175.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.424 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -70.36 -29.46 66.14 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -178.297 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.611 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 46.9 mtpt -64.9 -39.8 94.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.943 177.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 23.7 mtp180 -66.17 -48.02 72.09 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 174.023 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.424 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 32.2 tp -54.32 -50.17 67.99 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.138 -1.392 . . . . 0.0 112.488 -177.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -71.98 -28.86 63.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.84 0.353 . . . . 0.0 110.873 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -70.66 -50.3 38.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.878 0.37 . . . . 0.0 110.082 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.677 ' HE1' HD23 ' A' ' 54' ' ' LEU . 23.1 ptm -67.23 -36.59 81.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.713 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -54.17 -50.57 66.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.115 176.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -68.45 -46.35 70.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.131 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mmmt -53.16 -44.77 68.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.507 HG21 ' O ' ' A' ' 24' ' ' MET . 93.4 t -63.62 -42.47 96.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.011 0.434 . . . . 0.0 110.076 177.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 64.5 mtt -81.81 17.7 1.45 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.138 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -118.39 -11.71 9.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.066 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.596 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 13.7 t70 -85.44 145.77 27.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.86 0.362 . . . . 0.0 110.449 -177.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 -75.46 -35.47 60.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.668 -173.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -68.97 -40.41 78.89 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.82 -43.93 85.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.834 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.596 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 75.4 mm-40 -56.25 -49.88 72.92 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.242 0.544 . . . . 0.0 110.346 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.45 -49.34 78.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.243 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -63.91 -41.95 97.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.222 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 1.1 mm? -55.52 -51.42 67.07 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.105 -178.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.449 ' HB3' ' HE2' ' A' ' 39' ' ' LYS . 15.5 ptpt -74.67 -24.39 58.79 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.901 0.381 . . . . 0.0 110.99 -177.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -63.79 -46.2 86.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.307 0.575 . . . . 0.0 110.378 177.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -114.88 26.45 10.15 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.665 -176.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.408 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 10.8 pt-20 -67.89 -18.19 64.72 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.835 0.35 . . . . 0.0 111.501 -176.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -73.45 -26.46 60.95 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.287 0.565 . . . . 0.0 109.794 175.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.7 t -99.2 -42.58 10.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.056 -176.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.4 mt -80.15 144.2 11.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.378 -175.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -114.31 163.31 15.46 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.936 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -55.22 -43.15 74.24 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.309 0.576 . . . . 0.0 111.265 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -69.55 -36.31 76.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.287 -178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.416 ' HE1' ' HA ' ' A' ' 92' ' ' ARG . 57.8 ttm -56.13 -38.59 71.03 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.529 174.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.6 mm -61.77 -47.25 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.988 177.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 46.3 mt-10 -70.91 -30.62 67.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.499 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -70.68 -43.59 68.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.671 0.272 . . . . 0.0 110.752 176.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.0 m -92.92 19.61 7.54 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.41 -179.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.677 HD23 ' HE1' ' A' ' 24' ' ' MET . 0.5 OUTLIER -51.74 -51.72 54.02 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.13 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -52.94 -45.08 67.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.579 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.467 ' O ' HD13 ' A' ' 96' ' ' ILE . 38.3 mmtm -63.68 -53.69 47.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.211 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.36 -33.58 75.84 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.695 -177.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -73.65 -41.0 63.3 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.871 0.367 . . . . 0.0 110.477 178.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 42.1 tt0 -65.88 -33.04 74.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.495 0.664 . . . . 0.0 109.882 177.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -58.71 -51.61 69.24 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.6 177.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.0 pt -75.17 -28.25 20.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.876 -176.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.83 -33.06 64.0 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.031 -175.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 47.5 mt-30 -81.02 179.48 7.84 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.875 0.369 . . . . 0.0 111.145 -178.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.1 t -66.65 117.06 8.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.692 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -75.23 -27.0 59.35 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.394 0.616 . . . . 0.0 110.175 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -102.55 -160.89 0.81 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.41 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -154.46 157.84 39.03 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 177.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.6 t -79.21 -9.83 59.67 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.194 0.521 . . . . 0.0 110.703 -172.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -69.69 -11.56 60.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.211 0.529 . . . . 0.0 110.604 173.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 17.8 p -126.49 -40.33 1.95 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.255 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.2 m -99.0 153.44 18.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.1 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.44 16.12 6.92 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.229 0.538 . . . . 0.0 110.691 178.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -68.16 86.21 0.26 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.833 176.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -80.41 -11.27 59.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.055 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -81.1 -13.42 58.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.615 -175.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 66.9 m -87.96 115.53 25.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.516 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -78.06 108.11 11.1 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.245 177.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -120.12 135.63 54.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.817 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.662 ' HG ' HD23 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -104.29 -35.93 7.8 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.166 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.662 HD23 ' HG ' ' A' ' 79' ' ' LEU . 3.2 mm? -87.12 49.19 1.77 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.976 170.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -67.41 147.5 52.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.33 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 94.0 -9.03 73.14 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.467 -173.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.412 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 56.2 m-85 -125.0 171.81 9.93 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 99' ' ' TYR . 16.9 m170 -130.5 147.48 66.11 Favored Pre-proline 0 C--N 1.329 -0.291 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 171.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.96 135.49 15.64 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.363 2.042 . . . . 0.0 112.472 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -136.95 146.33 45.27 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 172.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.6 mt -80.72 142.95 33.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.802 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 23.2 m -139.94 141.36 34.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.938 175.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.1 p -93.37 114.68 30.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.498 0.666 . . . . 0.0 110.454 179.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -116.0 96.68 5.69 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.676 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.95 -112.98 4.71 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.665 -177.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.481 ' N ' ' HD2' ' A' ' 92' ' ' ARG . 8.0 mpt_? -106.85 0.9 24.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.909 0.385 . . . . 0.0 110.965 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 12.2 p -121.5 147.58 45.59 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.006 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 55.9 mt -103.66 124.57 58.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.956 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -109.77 177.62 4.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.245 0.545 . . . . 0.0 110.839 -175.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.467 HD13 ' O ' ' A' ' 56' ' ' LYS . 47.4 mt -126.53 105.88 14.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.283 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -105.46 150.75 25.02 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.237 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.412 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 17.2 m-85 -100.17 126.87 46.49 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.056 179.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.437 ' CZ ' ' HB2' ' A' ' 84' ' ' HIS . 54.3 p90 -105.49 144.34 32.39 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 173.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -63.2 138.71 58.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.111 0.481 . . . . 0.0 111.069 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 40.6 t -56.63 123.37 57.0 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.456 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.07 -17.15 58.78 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.815 2.343 . . . . 0.0 112.213 -178.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.9 t -69.63 -15.76 19.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.827 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt . . . . . 0 C--O 1.234 0.264 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.27 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.472 ' HA ' ' HB2' ' A' ' 19' ' ' LYS . 2.9 m-20 . . . . . 0 CA--C 1.52 -0.183 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -65.16 -54.89 22.82 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.468 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 3.2 pt20 -66.88 -30.23 70.34 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.41 178.145 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.472 ' HB2' ' HA ' ' A' ' 16' ' ' ASP . 5.9 mmmm -57.98 -48.41 80.06 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 174.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' A' ' 24' ' ' MET . 2.6 tpp180 -66.57 -45.2 80.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.385 177.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.468 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 26.8 tp -53.94 -49.42 68.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.319 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -67.02 -40.36 87.24 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.922 177.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.412 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 27.3 tt0 -59.29 -51.33 70.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.827 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.557 ' HE3' HD13 ' A' ' 54' ' ' LEU . 18.1 ptm -73.55 -37.37 65.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.078 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.483 ' HE2' ' HG2' ' A' ' 51' ' ' GLU . 4.5 tppp? -59.76 -40.51 88.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 110.143 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.68 -50.53 70.78 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.323 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -58.14 -47.0 84.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.524 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.514 ' HA ' HD12 ' A' ' 61' ' ' ILE . 74.8 t -62.66 -42.23 95.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.063 -177.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.434 ' HE3' HG22 ' A' ' 50' ' ' ILE . 24.3 mmt -82.98 15.52 2.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.751 0.31 . . . . 0.0 111.279 -178.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -107.27 -20.38 13.3 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.083 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.672 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 35.1 t70 -77.37 131.36 38.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.937 0.399 . . . . 0.0 111.237 -175.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -59.45 -45.61 91.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.808 -177.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.422 ' CG ' ' HZ2' ' A' ' 65' ' ' LYS . 5.6 m-20 -67.56 -39.43 84.93 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.423 -177.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.8 t -54.83 -49.61 68.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.661 174.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.672 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 36.0 mt-30 -64.38 -40.41 95.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.232 0.539 . . . . 0.0 110.607 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -59.77 -38.85 82.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.33 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.411 ' CZ ' HG23 ' A' ' 89' ' ' VAL . 59.3 t80 -69.82 -44.26 70.33 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.735 177.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.502 HD12 HD11 ' A' ' 50' ' ' ILE . 1.2 mm? -54.41 -47.91 72.23 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.355 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.6 pttt -76.11 -27.06 56.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.028 0.442 . . . . 0.0 111.114 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 5.3 tp10 -65.57 -42.45 91.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.134 0.492 . . . . 0.0 110.124 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -116.01 27.67 9.11 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.161 -176.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -66.94 -16.1 64.11 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.971 0.415 . . . . 0.0 111.734 -175.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -77.85 -19.41 54.91 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.109 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 40.4 t -113.68 -40.74 3.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.992 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.634 HG12 HG22 ' A' ' 89' ' ' VAL . 62.4 mt -72.09 141.92 15.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.499 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -115.48 164.1 14.78 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.461 -0.79 . . . . 0.0 108.87 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -59.92 -40.19 88.01 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -64.88 -38.17 90.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.648 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.6 tpp -58.73 -41.75 87.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.325 177.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.502 HD11 HD12 ' A' ' 38' ' ' LEU . 44.6 mm -61.95 -45.81 97.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.856 178.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.575 ' HA ' HD21 ' A' ' 54' ' ' LEU . 34.2 mt-10 -70.35 -33.85 71.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.126 -178.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -64.07 -41.52 97.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.125 0.488 . . . . 0.0 110.123 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.4 m -107.18 27.46 9.02 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.087 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.575 HD21 ' HA ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -55.29 -46.21 76.21 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 121.151 0.501 . . . . 0.0 110.024 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -63.72 -29.64 70.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.017 -176.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.472 ' O ' HD12 ' A' ' 96' ' ' ILE . 65.0 mmtt -68.19 -53.98 21.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.092 0.473 . . . . 0.0 110.103 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.2 mp -65.63 -36.74 84.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.724 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -65.83 -42.16 90.87 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.18 -0.463 . . . . 0.0 109.898 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -58.07 -48.21 80.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.619 175.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -56.13 -49.26 74.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.47 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.514 HD12 ' HA ' ' A' ' 28' ' ' VAL . 29.7 pt -75.13 -29.55 21.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -174.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -80.39 -30.69 37.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.661 0.267 . . . . 0.0 111.3 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -77.91 -171.78 2.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.159 0.504 . . . . 0.0 110.926 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 31.6 p -74.38 94.03 2.49 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.463 177.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.422 ' HZ2' ' CG ' ' A' ' 33' ' ' ASP . 18.1 ttmm -64.45 -32.93 74.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.614 0.721 . . . . 0.0 109.399 173.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.477 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.0 t-20 -92.22 -159.93 0.7 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.128 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.481 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -153.95 149.57 27.41 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.447 175.604 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.475 ' HA ' ' O ' ' A' ' 71' ' ' SER . 13.7 t -75.21 0.65 15.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.82 -173.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.422 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 5.3 t80 -82.41 -12.68 57.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.199 176.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.477 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 25.6 p -127.53 -40.81 1.75 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.57 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.475 ' O ' ' HA ' ' A' ' 68' ' ' SER . 50.2 p -98.34 149.29 22.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 174.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 14.9 tt0 -102.35 -2.93 27.93 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.782 -176.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.517 ' HB2' HD21 ' A' ' 75' ' ' ASN . 1.8 p30 -58.33 133.25 55.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.469 0.652 . . . . 0.0 110.557 -176.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -94.76 5.44 51.86 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.334 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . 0.517 HD21 ' HB2' ' A' ' 73' ' ' ASP . 53.2 m-80 -68.55 -39.74 80.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.889 -177.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 21.8 p -110.44 114.56 28.09 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.965 0.412 . . . . 0.0 110.181 176.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -74.86 107.47 6.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.676 0.751 . . . . 0.0 109.908 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.699 ' OD1' ' HA ' ' A' ' 81' ' ' GLU . 2.9 t-20 -87.98 103.75 15.98 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.772 -176.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 mp -65.53 -65.53 0.66 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.251 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.2 mp -80.4 77.14 7.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.348 174.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.699 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 29.8 tt0 -73.95 132.54 42.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.598 -175.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.14 -7.53 48.13 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.357 -176.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -122.29 162.91 20.61 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -126.04 147.22 58.49 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 169.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.78 136.79 28.52 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.315 2.01 . . . . 0.0 112.358 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.476 ' HB3' ' CD1' ' A' ' 99' ' ' TYR . 20.6 ptmt -128.11 131.72 49.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.416 179.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 76.2 mt -78.92 134.66 36.86 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.177 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.2 m -132.18 139.68 49.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.121 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.634 HG22 HG12 ' A' ' 45' ' ' ILE . 78.8 t -88.98 114.67 27.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.405 0.621 . . . . 0.0 109.673 175.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -117.05 95.32 4.94 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.133 -172.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.17 -113.94 6.29 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.062 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.518 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 0.2 OUTLIER -105.7 18.34 22.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.752 0.31 . . . . 0.0 111.386 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.3 m -138.98 167.62 21.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.09 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 76.2 mt -114.68 131.71 66.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -115.62 177.57 4.62 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 -176.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.472 HD12 ' O ' ' A' ' 56' ' ' LYS . 51.0 mt -132.98 108.88 13.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.285 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -99.55 -174.93 2.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.809 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -133.37 124.26 26.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.927 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.476 ' CD1' ' HB3' ' A' ' 86' ' ' LYS . 55.2 p90 -107.22 152.12 24.52 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.14 130.29 39.49 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.417 0.627 . . . . 0.0 110.616 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.9 t -46.31 122.88 6.75 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.587 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -60.51 -9.58 11.45 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.132 2.555 . . . . 0.0 113.099 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 91.8 t -78.44 -25.23 13.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 177.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.9 tttp . . . . . 0 C--N 1.332 -0.175 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.605 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.469 0.493 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -52.46 -46.97 66.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.2 177.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.41 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -71.43 -30.06 65.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.243 0.544 . . . . 0.0 110.04 -177.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -71.13 -42.54 69.08 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.382 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -72.52 -32.26 65.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.751 0.31 . . . . 0.0 110.577 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 tp -65.22 -49.48 69.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.388 177.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.534 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 7.0 mm-40 -73.18 -25.0 60.62 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.923 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -61.96 -56.91 14.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.759 0.314 . . . . 0.0 111.398 174.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.615 ' HE3' HD12 ' A' ' 54' ' ' LEU . 23.7 ptm -61.14 -35.56 77.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.956 0.407 . . . . 0.0 109.995 176.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.534 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 4.1 tptm -57.78 -46.18 84.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.923 173.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.465 ' CD ' ' HZ3' ' A' ' 30' ' ' LYS . 8.0 tp10 -53.11 -49.25 66.87 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 123.665 0.786 . . . . 0.0 111.103 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.408 ' HE2' ' HB3' ' A' ' 27' ' ' LYS . 11.5 mmmm -59.02 -49.42 77.97 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.783 177.248 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.512 HG21 ' O ' ' A' ' 24' ' ' MET . 57.6 t -64.18 -41.24 91.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.723 -175.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 14.8 ptp -73.73 -4.72 36.23 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -171.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.465 ' HZ3' ' CD ' ' A' ' 26' ' ' GLU . 6.2 mtpt -127.62 -4.08 5.95 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.471 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 0.3 OUTLIER -77.38 126.74 31.39 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.179 0.514 . . . . 0.0 110.239 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -66.68 -33.01 74.7 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.972 -168.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -66.46 -41.23 89.37 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.789 0.328 . . . . 0.0 110.236 177.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 91.3 t -58.28 -44.82 88.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.289 172.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 84.4 mm-40 -55.38 -50.47 69.64 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.922 178.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -54.67 -42.62 71.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.26 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -68.85 -43.44 75.45 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.692 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.697 HD11 HD12 ' A' ' 50' ' ' ILE . 2.4 mm? -61.03 -44.7 97.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.445 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 ptmm? -70.83 -26.05 63.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.045 0.45 . . . . 0.0 110.508 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -73.85 -44.23 56.16 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.974 0.416 . . . . 0.0 110.588 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -112.74 29.02 8.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.505 -176.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -64.22 -22.54 66.98 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.031 0.444 . . . . 0.0 111.354 -176.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -75.11 -25.99 58.91 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.534 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.5 t -101.07 -42.37 9.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.99 -174.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.532 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 65.3 mt -77.87 142.63 13.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.794 -175.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -118.24 165.7 13.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.707 176.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -55.68 -44.33 77.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.901 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.401 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 51.6 mtpt -66.14 -36.89 84.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.086 0.469 . . . . 0.0 110.706 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.696 ' HE1' HG21 ' A' ' 89' ' ' VAL . 23.0 ttt -60.13 -35.83 76.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.201 177.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.697 HD12 HD11 ' A' ' 38' ' ' LEU . 37.0 mm -64.57 -54.45 30.24 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.839 176.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.494 ' HA ' HD22 ' A' ' 54' ' ' LEU . 7.7 mm-40 -57.53 -42.18 82.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.024 0.44 . . . . 0.0 111.014 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -65.36 -29.73 70.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.082 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.439 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 7.3 m -114.26 20.5 15.49 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.38 -178.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.615 HD12 ' HE3' ' A' ' 24' ' ' MET . 0.1 OUTLIER -58.88 -44.7 91.19 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.922 -177.633 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -60.6 -33.67 73.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.782 178.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.565 ' O ' HD12 ' A' ' 96' ' ' ILE . 32.1 mmmt -73.22 -42.76 62.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 110.91 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.458 HD23 HG23 ' A' ' 94' ' ' ILE . 76.2 mt -65.51 -38.79 90.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.143 0.497 . . . . 0.0 110.132 177.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -70.3 -39.26 74.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.115 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.504 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 38.0 tt0 -57.21 -39.72 76.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.012 175.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -59.51 -52.21 66.55 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.525 177.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.7 pt -74.34 -29.0 23.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -174.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.504 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 7.6 pt-20 -75.63 -20.73 58.31 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.811 178.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 46.3 mt-30 -74.36 -167.15 0.49 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.925 0.393 . . . . 0.0 110.322 174.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.549 ' HB2' ' C ' ' A' ' 77' ' ' ASN . 20.0 t -83.74 130.16 34.95 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.881 0.372 . . . . 0.0 111.212 -177.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -73.05 -26.6 61.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.533 0.682 . . . . 0.0 109.574 173.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.48 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 76.6 m-20 -122.78 -160.09 0.87 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.608 -177.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.435 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 6.8 p -152.63 161.11 43.01 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 176.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.581 ' HB3' ' HG3' ' A' ' 81' ' ' GLU . 48.1 t -60.24 -29.22 68.63 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 123.49 0.494 . . . . 0.0 111.285 -174.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -72.37 -1.92 17.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.032 0.444 . . . . 0.0 111.617 -178.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.9 p -136.31 6.94 3.08 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.591 175.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 38.5 t -145.35 118.65 8.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.865 0.364 . . . . 0.0 110.302 -176.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -81.81 -6.69 59.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.03 177.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -79.73 134.13 36.37 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.019 -174.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -64.28 -26.4 68.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.079 -0.51 . . . . 0.0 112.328 -176.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -81.49 67.45 7.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.824 0.821 . . . . 0.0 110.238 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.45 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 15.7 p -115.51 116.92 29.0 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.454 172.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.549 ' C ' ' HB2' ' A' ' 64' ' ' SER . 56.4 m-20 -79.08 21.81 0.43 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.653 -173.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.45 ' OD1' ' HB2' ' A' ' 76' ' ' CYS . 3.0 p-10 -103.66 128.06 51.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.153 0.501 . . . . 0.0 111.272 -177.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.839 ' HG ' HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -90.73 -26.89 19.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 168.869 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.839 HD11 ' HG ' ' A' ' 79' ' ' LEU . 5.5 mp -85.51 110.3 19.1 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.258 173.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.581 ' HG3' ' HB3' ' A' ' 68' ' ' SER . 33.5 tt0 -88.48 142.05 28.03 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.091 0.472 . . . . 0.0 110.541 -179.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.2 -8.78 77.44 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.887 176.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -126.43 160.3 30.89 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.919 0.359 . . . . 0.0 110.989 -177.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.48 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 13.1 m170 -128.07 149.32 70.67 Favored Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.005 177.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.98 153.54 25.33 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.548 2.166 . . . . 0.0 112.166 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -152.6 151.96 31.25 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -82.57 142.65 31.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.964 0.411 . . . . 0.0 110.346 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.483 ' CG2' ' HB3' ' A' ' 95' ' ' ASP . 33.1 m -132.49 155.42 41.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.622 176.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.696 HG21 ' HE1' ' A' ' 49' ' ' MET . 4.3 p -99.92 115.15 40.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-O 121.168 0.508 . . . . 0.0 110.08 175.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -120.17 95.82 4.9 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.866 177.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.64 -124.11 28.41 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.088 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -96.59 13.9 26.61 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.83 0.348 . . . . 0.0 111.0 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.5 m -125.24 144.42 50.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.663 -178.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.458 HG23 HD23 ' A' ' 57' ' ' LEU . 60.8 mt -97.56 131.78 43.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 174.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.483 ' HB3' ' CG2' ' A' ' 88' ' ' VAL . 41.3 t0 -126.46 178.08 6.08 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.745 0.307 . . . . 0.0 110.254 -170.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.565 HD12 ' O ' ' A' ' 56' ' ' LYS . 77.0 mt -124.39 129.94 73.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-O 121.249 0.547 . . . . 0.0 110.273 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -122.49 172.33 8.44 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.283 177.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -124.42 134.99 52.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.008 0.432 . . . . 0.0 111.268 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -118.21 151.2 38.08 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.561 ' HG2' ' HD3' ' A' ' 104' ' ' LYS . 24.4 tt0 -71.84 137.19 47.36 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.979 0.419 . . . . 0.0 110.582 -175.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.452 ' SG ' HG11 ' A' ' 103' ' ' VAL . 19.8 t -47.58 124.8 9.8 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.505 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.37 -10.91 25.74 Favored 'Trans proline' 0 N--CA 1.474 0.337 0 C-N-CA 123.198 2.599 . . . . 0.0 113.493 -176.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.452 HG11 ' SG ' ' A' ' 101' ' ' CYS . 9.8 p -66.61 -19.39 25.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.282 0.563 . . . . 0.0 110.306 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.658 ' HB3' ' HZ3' ' A' ' 104' ' ' LYS . 8.3 mtpm? . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.219 -178.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 . . . . . 0 C--O 1.234 0.261 0 CA-C-O 120.935 0.398 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -52.17 -47.64 65.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.537 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 1.7 pt20 -68.88 -30.75 69.32 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.208 -175.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 30.3 mmtm -72.13 -38.16 69.32 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -175.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.1 ptt85 -75.52 -23.78 56.73 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.444 176.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.4 tp -70.48 -48.57 55.12 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.12 174.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 18' ' ' GLN . 37.0 mt-10 -58.92 -43.2 91.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.884 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -58.29 -53.71 55.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.999 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.596 ' O ' HG22 ' A' ' 28' ' ' VAL . 26.3 ptm -68.68 -42.3 78.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.287 -177.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -61.25 -43.06 99.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.719 0.295 . . . . 0.0 110.777 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -64.88 -46.4 81.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.059 0.457 . . . . 0.0 110.173 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -55.75 -45.39 78.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.949 178.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.596 HG22 ' O ' ' A' ' 24' ' ' MET . 74.3 t -62.08 -37.54 78.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.939 0.4 . . . . 0.0 110.79 -179.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.8 mtp -82.3 -2.97 54.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.59 -178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -103.8 -6.57 21.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.305 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 26.1 t70 -77.93 137.61 38.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.824 0.345 . . . . 0.0 110.489 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -67.57 -43.47 80.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.483 -175.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -70.42 -43.67 69.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.53 -177.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.9 t -54.99 -55.18 17.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.855 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.421 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 2.1 pt20 -65.61 -34.21 77.7 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -176.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.91 -41.61 86.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.265 0.555 . . . . 0.0 110.192 175.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -61.8 -38.94 89.99 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.812 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.793 HD12 HD12 ' A' ' 50' ' ' ILE . 1.6 mm? -61.25 -50.47 72.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.794 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -70.0 -23.1 63.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.025 0.44 . . . . 0.0 111.054 -177.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -76.15 -37.52 57.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.958 176.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -110.71 25.18 12.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.701 -174.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -63.67 -20.78 65.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.076 0.465 . . . . 0.0 111.311 -176.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -75.5 -20.44 58.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.574 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.4 t -108.06 -46.98 7.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.802 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.459 HD12 HG21 ' A' ' 89' ' ' VAL . 54.6 mt -81.33 144.16 10.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.979 -173.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.481 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -130.83 -178.65 4.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.442 176.454 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -64.36 -42.25 96.31 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -60.03 -44.79 94.39 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.589 0.233 . . . . 0.0 110.609 177.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.429 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 38.5 ttm -56.25 -38.95 71.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.537 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.793 HD12 HD12 ' A' ' 38' ' ' LEU . 46.1 mm -60.52 -54.12 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.945 177.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -62.09 -38.11 87.63 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.129 0.49 . . . . 0.0 111.068 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -69.68 -26.46 64.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.608 -178.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 77.3 p -114.37 16.48 17.82 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.265 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.464 HD23 ' HE3' ' A' ' 24' ' ' MET . 0.7 OUTLIER -53.94 -42.68 69.09 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.456 0.646 . . . . 0.0 110.508 178.296 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.502 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 24.4 p-10 -59.67 -44.46 93.59 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.738 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.563 ' O ' HD13 ' A' ' 96' ' ' ILE . 31.1 mmmt -67.48 -49.94 61.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.557 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.6 -41.07 76.39 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.531 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -67.39 -42.77 82.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.072 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 15.9 mm-40 -58.87 -39.36 81.12 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-O 120.9 0.381 . . . . 0.0 110.763 177.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -58.88 -51.33 70.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.531 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.6 pt -71.64 -29.69 35.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.702 -174.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.75 -23.25 55.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.014 0.435 . . . . 0.0 111.093 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 46.9 mt-30 -80.26 167.75 19.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.048 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.2 m -66.9 113.4 4.92 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.52 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -64.83 -26.19 68.23 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.781 172.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -102.19 -163.18 0.98 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.664 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.7 p -159.6 158.04 30.9 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.0 m -67.32 -25.4 66.0 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.067 0.461 . . . . 0.0 110.775 -172.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.496 ' CE2' ' HB3' ' A' ' 104' ' ' LYS . 1.3 t80 -67.76 -5.89 18.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.57 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 28.7 p -135.92 2.63 2.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.749 0.309 . . . . 0.0 111.1 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.8 m -124.33 145.27 49.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.898 0.38 . . . . 0.0 110.16 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -77.26 -13.55 59.92 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.271 0.557 . . . . 0.0 110.844 -175.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.746 ' HB3' ' HG ' ' A' ' 76' ' ' CYS . 0.3 OUTLIER -80.13 87.06 5.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.435 179.561 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -68.37 -11.13 59.11 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.583 0.706 . . . . 0.0 110.151 175.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -73.71 -17.58 61.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.218 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.746 ' HG ' ' HB3' ' A' ' 73' ' ' ASP . 59.8 m -71.27 117.4 12.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.892 0.377 . . . . 0.0 111.023 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -87.31 99.83 12.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.996 0.427 . . . . 0.0 110.007 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -102.05 129.75 48.44 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.499 -177.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.461 ' HG ' HD13 ' A' ' 80' ' ' LEU . 2.5 pt? -66.9 -24.35 66.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.415 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.461 HD13 ' HG ' ' A' ' 79' ' ' LEU . 5.3 mp -141.96 103.84 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 174.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -94.69 150.49 20.17 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 -176.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.52 -9.41 77.18 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.389 -174.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -124.18 166.99 14.88 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.7 m170 -127.62 146.84 60.12 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 169.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.3 145.77 39.13 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.063 1.842 . . . . 0.0 111.513 175.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -142.03 149.63 40.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.096 177.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.7 mt -83.59 135.59 34.56 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.058 177.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.415 HG11 ' HG3' ' A' ' 97' ' ' GLU . 29.7 m -133.81 150.63 31.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.515 HG23 HG12 ' A' ' 94' ' ' ILE . 48.4 t -109.84 112.67 41.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.341 0.591 . . . . 0.0 109.499 172.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -108.87 104.07 13.25 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.798 -177.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.74 -105.03 1.42 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.833 -0.699 . . . . 0.0 111.525 -177.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -117.21 5.06 12.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.737 0.303 . . . . 0.0 110.575 178.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.6 p -122.29 138.02 54.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.789 0.328 . . . . 0.0 111.392 -176.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.515 HG12 HG23 ' A' ' 89' ' ' VAL . 66.1 mt -90.53 137.52 21.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.848 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -134.38 178.86 6.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.808 0.337 . . . . 0.0 110.774 -176.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.563 HD13 ' O ' ' A' ' 56' ' ' LYS . 51.8 mt -123.49 110.61 26.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.354 -177.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.415 ' HG3' HG11 ' A' ' 88' ' ' VAL . 7.0 mm-40 -102.83 179.45 4.28 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.24 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -128.25 133.56 48.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.586 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -115.91 140.59 49.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.007 174.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -56.82 127.11 30.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.906 178.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.2 t -52.71 122.31 26.4 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.792 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -63.02 -1.12 2.56 Favored 'Trans proline' 0 N--CA 1.476 0.494 0 C-N-CA 123.37 2.713 . . . . 0.0 113.432 -176.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.8 t -79.83 -44.3 23.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.412 175.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.496 ' HB3' ' CE2' ' A' ' 69' ' ' TYR . 14.7 ptmm? . . . . . 0 C--N 1.333 -0.139 0 CA-C-O 120.853 0.359 . . . . 0.0 110.874 -178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.404 ' OD2' ' HD2' ' A' ' 20' ' ' ARG . 16.2 t70 . . . . . 0 N--CA 1.466 0.338 0 CA-C-O 120.533 0.206 . . . . 0.0 111.278 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -53.74 -56.12 20.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.17 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.416 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -72.11 -30.64 65.28 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.208 -176.818 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -67.56 -46.5 72.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.475 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.487 ' O ' ' HG2' ' A' ' 24' ' ' MET . 11.4 ptm180 -71.15 -26.59 63.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.0 tp -68.69 -48.82 62.93 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.973 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 11.6 pt-20 -70.77 -30.58 67.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.75 0.309 . . . . 0.0 110.59 175.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -64.73 -53.89 40.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.697 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.487 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 12.0 ptp -61.79 -38.65 88.89 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.464 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.46 ' O ' ' HG2' ' A' ' 29' ' ' MET . 4.3 tppp? -56.15 -50.26 71.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.323 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.24 -49.93 75.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.635 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -52.01 -51.84 54.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.773 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.44 ' CG1' HG12 ' A' ' 34' ' ' VAL . 84.7 t -62.8 -34.42 65.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.326 -177.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.46 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.7 mmt -73.74 -8.93 57.92 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.452 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -102.94 -8.64 20.51 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -176.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.412 ' CG ' ' HZ1' ' A' ' 65' ' ' LYS . 33.5 t70 -85.28 131.15 34.46 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.391 -175.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.36 -42.06 98.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.152 -178.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -68.99 -45.4 70.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.018 0.437 . . . . 0.0 110.438 -175.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.44 HG12 ' CG1' ' A' ' 28' ' ' VAL . 44.7 t -56.85 -55.41 20.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.534 178.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -65.3 -31.64 72.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.799 0.333 . . . . 0.0 111.447 -176.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.2 -42.34 88.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.977 0.418 . . . . 0.0 110.526 174.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -65.75 -37.57 86.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.734 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 38' ' ' LEU . 1.3 mm? -57.85 -44.89 86.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.242 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.531 ' HZ1' ' HB2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -80.04 -24.21 40.89 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.77 0.319 . . . . 0.0 110.681 179.673 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.88 -49.89 73.07 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.313 0.578 . . . . 0.0 110.343 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -115.62 31.42 6.72 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.273 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.88 -23.41 65.16 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -175.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -85.13 -25.45 27.47 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.222 0.535 . . . . 0.0 110.661 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.4 t -96.12 -40.83 11.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.117 -174.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.7 mt -70.53 140.54 18.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.836 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -91.92 151.02 20.72 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.53 176.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -61.4 -36.28 79.86 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -63.61 -43.06 98.0 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.321 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.469 ' HE1' ' HA ' ' A' ' 92' ' ' ARG . 45.2 ttm -55.63 -37.87 68.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.9 178.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.6 mm -63.24 -49.11 84.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.866 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -58.47 -38.04 76.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.264 0.554 . . . . 0.0 110.777 178.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -77.68 -29.96 51.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.476 -176.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 m -106.06 11.68 31.21 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -174.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.8 tp -57.33 -38.1 73.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.867 0.365 . . . . 0.0 110.656 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -60.21 -39.43 86.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.089 177.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -69.9 -43.02 72.59 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.966 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.412 ' O ' HG23 ' A' ' 61' ' ' ILE . 10.8 mp -61.89 -40.63 96.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.351 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.458 ' O ' HG12 ' A' ' 61' ' ' ILE . 13.3 t80 -66.88 -44.17 81.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.993 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.11 -45.33 91.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.383 0.611 . . . . 0.0 110.064 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -58.79 -40.26 83.52 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.595 -178.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.515 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 23.4 pt -75.55 -30.11 21.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.551 -176.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -83.79 -22.76 31.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.785 0.326 . . . . 0.0 111.081 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -105.21 145.01 31.2 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -172.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.59 ' HB3' ' HG3' ' A' ' 85' ' ' PRO . 25.6 t 53.33 34.72 18.53 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 160.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.515 ' HE2' ' HA ' ' A' ' 61' ' ' ILE . 52.8 mmtt -63.02 -26.07 68.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.918 -0.489 . . . . 0.0 111.347 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -131.59 -166.95 1.79 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.042 0.448 . . . . 0.0 110.328 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.8 p -158.13 161.42 37.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.9 p -62.81 -26.68 68.86 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.221 0.534 . . . . 0.0 112.398 -171.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 104' ' ' LYS . 1.2 t80 -69.0 -16.66 63.78 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.753 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.445 ' HB3' HG21 ' A' ' 103' ' ' VAL . 25.8 p -124.8 5.71 8.1 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.81 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 m -137.16 152.72 50.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 179.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -82.03 -20.03 39.19 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.49 105.39 0.52 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.016 173.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -80.09 -13.39 59.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.223 0.535 . . . . 0.0 110.776 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -87.1 74.61 9.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.471 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 36.2 m -86.47 139.29 31.03 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.672 -176.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -92.26 37.7 0.99 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 171.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -115.26 138.2 51.2 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.176 -172.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.4 mp -80.14 -68.57 0.66 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.423 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.413 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 7.4 mp -85.49 100.83 12.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.876 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -63.68 139.5 58.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.125 0.488 . . . . 0.0 110.698 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.87 -8.69 79.0 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.454 -176.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -121.96 168.87 11.4 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 122.248 0.219 . . . . 0.0 110.516 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -131.97 153.72 81.48 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . 0.59 ' HG3' ' HB3' ' A' ' 64' ' ' SER . 93.9 Cg_endo -79.0 151.15 23.8 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.638 2.226 . . . . 0.0 112.085 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -147.85 137.36 22.44 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.645 176.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.9 mt -68.4 131.76 45.87 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.326 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 18.7 m -135.8 149.92 28.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.798 178.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.9 p -104.33 116.75 48.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.386 0.612 . . . . 0.0 110.765 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -112.91 99.0 7.54 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.445 176.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.75 -118.36 6.07 Favored Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.432 -175.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.469 ' HA ' ' HE1' ' A' ' 49' ' ' MET . 34.8 mmt180 -111.12 14.17 21.85 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.922 0.392 . . . . 0.0 110.663 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.6 p -122.26 141.9 51.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.677 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 84.1 mt -97.53 130.21 46.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.962 0.411 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -118.12 175.3 5.75 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.427 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 58.1 mt -128.14 98.06 4.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.787 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -103.91 -175.86 2.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.718 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.413 ' CD2' ' HB2' ' A' ' 80' ' ' LEU . 9.1 m-85 -123.8 138.48 54.5 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -171.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -115.06 157.45 23.5 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 170.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -73.69 142.71 46.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.808 0.337 . . . . 0.0 111.613 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.7 t -60.55 122.77 70.27 Favored Pre-proline 0 C--N 1.333 -0.135 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.563 177.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -58.72 -17.03 33.76 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.995 2.463 . . . . 0.0 112.761 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.445 HG21 ' HB3' ' A' ' 70' ' ' CYS . 93.0 t -66.49 -16.85 21.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.953 175.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 69' ' ' TYR . 36.7 ttpt . . . . . 0 C--N 1.33 -0.249 0 CA-C-O 121.313 0.578 . . . . 0.0 109.829 177.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.606 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 1.2 m-20 . . . . . 0 CA--C 1.523 -0.089 0 N-CA-C 111.536 0.198 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -59.83 -52.8 63.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 173.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.13 -33.24 69.91 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.606 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 45.1 mtpt -58.71 -44.23 90.31 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.218 176.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.45 ' O ' ' HG2' ' A' ' 24' ' ' MET . 18.0 tpp85 -69.45 -51.36 36.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.704 177.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.7 tp -58.07 -49.86 75.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.467 -175.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -76.94 -27.3 54.78 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 8.7 tt0 -63.12 -55.57 24.21 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 120.923 0.392 . . . . 0.0 110.077 175.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.62 ' O ' HG22 ' A' ' 28' ' ' VAL . 25.9 ptm -61.84 -34.02 75.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.158 177.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.445 ' HE3' ' HB2' ' A' ' 25' ' ' LYS . 3.7 tppp? -55.29 -55.62 29.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.101 174.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.563 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 39.4 tt0 -62.68 -40.39 96.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.651 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 27' ' ' LYS . 5.2 mmmm -52.39 -39.82 61.32 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.467 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.706 HG13 HG13 ' A' ' 34' ' ' VAL . 68.0 t -70.27 -39.01 76.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.11 -178.394 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 65.7 mtt -73.9 -4.81 37.32 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.532 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 27.3 mmtp -98.81 -5.82 30.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.738 0.304 . . . . 0.0 111.506 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -84.81 141.34 30.55 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.111 0.481 . . . . 0.0 111.201 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -69.94 -39.93 75.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.899 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -77.49 -42.15 36.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.902 0.382 . . . . 0.0 109.997 -174.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.706 HG13 HG13 ' A' ' 28' ' ' VAL . 40.0 t -54.57 -55.49 14.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.214 177.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.44 -32.56 74.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.755 0.312 . . . . 0.0 111.217 -177.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.69 -40.12 92.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.003 174.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -65.77 -40.45 92.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.608 176.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.812 HD12 HD11 ' A' ' 50' ' ' ILE . 2.0 mm? -57.54 -45.61 84.89 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.468 178.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -79.77 -20.46 46.22 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.926 0.394 . . . . 0.0 110.804 -178.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -68.4 -52.33 34.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.551 0.691 . . . . 0.0 109.966 176.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -106.86 29.97 6.55 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.329 -177.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -64.68 -16.08 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.283 0.563 . . . . 0.0 110.676 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.12 -19.89 59.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.579 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 39.8 t -119.37 -37.37 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.542 -173.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.8 mt -73.52 140.14 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.322 0.582 . . . . 0.0 111.919 -174.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.79 165.28 11.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.21 176.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -67.89 -36.99 81.2 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 172.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -57.69 -43.66 85.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.227 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.537 ' HE3' ' HA ' ' A' ' 92' ' ' ARG . 46.6 ttm -59.78 -37.17 78.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.851 178.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.812 HD11 HD12 ' A' ' 38' ' ' LEU . 38.6 mm -63.25 -54.89 27.25 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.174 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.8 mm-40 -50.83 -46.93 60.2 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 122.978 0.511 . . . . 0.0 111.459 176.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -68.74 -38.94 80.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.991 -177.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.411 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 5.6 m -101.67 17.38 23.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.342 0.592 . . . . 0.0 110.337 -176.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.406 HD21 HG22 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -65.36 -43.81 89.64 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.343 -174.658 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -57.54 -34.48 69.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.715 175.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.41 ' O ' HD11 ' A' ' 96' ' ' ILE . 66.5 mmtt -67.27 -53.65 28.01 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.903 0.382 . . . . 0.0 110.807 178.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.435 HD13 HG21 ' A' ' 94' ' ' ILE . 10.9 mp -62.72 -39.68 94.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.465 -177.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.41 ' O ' ' HG2' ' A' ' 62' ' ' GLU . 48.2 t80 -67.5 -41.24 84.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.986 0.422 . . . . 0.0 110.383 178.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 23.5 tt0 -62.54 -41.18 98.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.978 178.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -56.03 -52.81 62.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.832 178.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.6 pt -69.39 -29.86 43.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -174.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 58' ' ' TYR . 60.9 mm-40 -79.17 -17.04 55.69 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.923 0.392 . . . . 0.0 110.927 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 22.7 mt-30 -82.42 -175.3 5.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.423 0.63 . . . . 0.0 111.904 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.1 p -74.42 114.7 13.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.016 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -73.78 -27.53 61.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.912 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.482 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.0 t-20 -115.24 -170.64 1.8 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.03 -170.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -134.23 143.69 47.97 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.735 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 11.9 t -71.93 -11.5 60.82 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.256 -169.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.428 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 34.4 t80 -63.51 -31.75 73.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.917 175.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.482 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 32.1 p -114.64 -20.17 10.8 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.582 -0.447 . . . . 0.0 112.072 -173.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.5 p -113.42 142.85 45.4 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -112.51 24.55 12.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.525 0.678 . . . . 0.0 110.028 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.14 139.81 46.65 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.963 175.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -62.59 -24.03 67.34 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.937 -178.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -102.31 -1.39 31.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.669 -174.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 17.5 p -93.26 19.8 7.74 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.68 -174.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -71.84 96.35 1.64 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.425 0.631 . . . . 0.0 110.189 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.422 ' OD1' HD21 ' A' ' 79' ' ' LEU . 44.9 t-20 -87.14 141.95 28.27 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.335 -179.188 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.422 HD21 ' OD1' ' A' ' 78' ' ' ASN . 2.3 pt? -61.59 -40.56 95.21 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.055 0.455 . . . . 0.0 110.031 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 24.3 mt -86.32 158.36 19.68 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 172.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -140.48 131.16 25.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.483 0.658 . . . . 0.0 110.742 -170.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 80.69 6.08 89.58 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.893 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.419 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 77.2 m-85 -132.51 156.45 46.77 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 122.261 0.224 . . . . 0.0 110.533 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -126.95 150.6 72.29 Favored Pre-proline 0 N--CA 1.466 0.347 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 175.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.55 149.89 27.54 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 122.552 2.168 . . . . 0.0 112.408 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.1 pttt -147.34 160.1 42.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.118 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -87.2 138.54 31.4 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.527 HG13 ' OE1' ' A' ' 97' ' ' GLU . 18.1 m -133.5 150.39 32.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.554 178.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 p -102.46 120.7 52.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.47 0.652 . . . . 0.0 110.789 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -122.54 99.94 6.67 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.732 176.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.66 -111.64 4.21 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.548 -176.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.537 ' HA ' ' HE3' ' A' ' 49' ' ' MET . 6.3 mpt_? -114.4 15.82 17.89 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.187 0.518 . . . . 0.0 109.884 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.1 p -125.89 138.65 53.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.762 -178.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.435 HG21 HD13 ' A' ' 57' ' ' LEU . 67.4 mt -98.3 132.88 42.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 178.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -124.89 178.92 5.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -176.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.41 HD11 ' O ' ' A' ' 56' ' ' LYS . 50.2 mt -124.51 108.78 21.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.866 0.365 . . . . 0.0 110.59 -176.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.527 ' OE1' HG13 ' A' ' 88' ' ' VAL . 51.5 mt-10 -106.87 -178.14 3.56 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.134 177.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.419 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 4.5 m-85 -123.72 132.84 53.91 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.739 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -110.01 154.5 23.09 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -72.77 136.95 45.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.29 0.566 . . . . 0.0 110.848 -175.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.404 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 49.2 t -59.29 126.1 80.92 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.051 178.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 9.4 Cg_endo -55.7 -24.0 43.75 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.795 2.33 . . . . 0.0 111.984 176.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 t -81.44 -14.27 12.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.176 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 28.7 tptp . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.535 -173.346 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.3 t70 . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.91 0.386 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -65.58 -48.42 72.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.693 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.42 -31.67 70.16 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -179.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 52.1 mtpt -60.43 -50.11 74.88 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.987 175.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -63.95 -45.96 86.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.247 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.7 tp -58.06 -50.14 74.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.664 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -75.71 -26.97 58.02 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.4 tp-100 -57.98 -57.06 14.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.108 0.48 . . . . 0.0 109.713 174.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.634 ' HE3' ' HG ' ' A' ' 54' ' ' LEU . 25.8 ptm -65.65 -36.08 82.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.522 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -54.01 -52.54 60.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.564 175.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 38.2 tt0 -66.8 -43.56 83.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.866 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.3 mtpt -56.09 -41.86 75.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.639 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 24' ' ' MET . 73.7 t -64.44 -44.07 97.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.693 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.438 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 23.6 ptp -82.03 2.1 32.6 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.195 0.521 . . . . 0.0 110.765 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 13.9 tptt -94.74 -29.24 14.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.048 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -66.27 143.95 56.9 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.398 0.618 . . . . 0.0 111.538 -174.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -69.11 -47.14 65.93 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.444 -175.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -71.45 -42.8 67.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.798 -177.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.481 HG23 HD12 ' A' ' 87' ' ' LEU . 51.0 t -56.48 -54.6 26.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.758 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -65.92 -30.71 71.33 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.383 -176.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.536 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . . . -62.52 -44.31 96.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.127 174.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.423 ' CE2' HD11 ' A' ' 45' ' ' ILE . 60.1 t80 -64.13 -39.62 94.42 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.676 177.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.582 HD13 HD12 ' A' ' 50' ' ' ILE . 2.6 mm? -58.37 -51.78 68.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.636 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.536 ' HE3' ' HA ' ' A' ' 36' ' ' ALA . 23.4 pttp -67.42 -28.16 67.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.023 0.439 . . . . 0.0 110.764 -177.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.81 -28.29 62.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.735 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -122.92 26.81 7.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.707 -174.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -66.52 -15.99 63.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.204 0.526 . . . . 0.0 110.968 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -70.9 -34.83 71.94 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.187 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 19.2 t -102.63 -39.56 6.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.366 -172.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 37' ' ' PHE . 63.9 mt -75.96 138.46 20.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.069 -175.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.447 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -131.44 -177.72 4.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.905 -178.311 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -57.93 -41.47 82.8 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.758 0.313 . . . . 0.0 111.487 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -71.05 -42.04 69.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.58 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 45.9 tpp -56.26 -36.2 68.3 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.778 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.582 HD12 HD13 ' A' ' 38' ' ' LEU . 41.4 mm -63.94 -49.27 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.896 177.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -68.65 -37.85 79.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.853 -178.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -58.94 -48.47 81.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.158 0.504 . . . . 0.0 110.863 176.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.634 ' OG ' ' HB ' ' A' ' 94' ' ' ILE . 33.6 t -98.8 17.03 20.41 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.769 -173.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.634 ' HG ' ' HE3' ' A' ' 24' ' ' MET . 41.4 tp -60.16 -38.15 82.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.794 0.33 . . . . 0.0 110.457 -178.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -74.17 -35.7 64.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.204 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -66.63 -47.01 73.93 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.856 0.36 . . . . 0.0 110.811 177.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 53' ' ' SER . 95.1 mt -66.2 -39.07 89.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.632 -178.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -71.61 -37.89 70.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.241 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.66 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 31.2 tt0 -64.29 -36.81 85.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.186 0.517 . . . . 0.0 109.806 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.513 ' CE1' ' HB2' ' A' ' 85' ' ' PRO . 79.8 t80 -56.46 -51.15 69.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.184 176.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -74.9 -29.7 22.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -174.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.66 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 7.5 pt-20 -80.14 -13.07 59.55 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.167 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.537 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 45.6 mt-30 -85.63 -177.58 6.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.022 0.439 . . . . 0.0 110.54 174.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.1 t -87.47 105.15 17.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.311 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -69.4 -26.34 64.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.418 . . . . 0.0 109.991 175.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -83.0 -178.27 7.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.881 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 p -147.41 154.7 41.18 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.488 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 3.0 p -55.24 -33.48 63.16 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 124.239 0.962 . . . . 0.0 112.334 -174.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -62.54 -9.89 10.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.722 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.2 p -140.17 -0.79 1.61 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.449 ' OG ' ' HA ' ' A' ' 68' ' ' SER . 27.0 p -105.79 107.23 18.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.385 0.612 . . . . 0.0 111.307 -176.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -86.28 67.87 10.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.745 1.26 . . . . 0.0 109.255 176.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -153.79 156.97 38.69 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 113.006 -1.906 . . . . 0.0 108.435 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.64 -20.36 65.62 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 123.432 0.458 . . . . 0.0 111.563 -178.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -69.65 80.6 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.66 0.743 . . . . 0.0 111.2 177.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 68' ' ' SER . 48.3 t -108.11 23.54 14.34 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.073 176.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -83.44 25.02 0.78 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.982 -174.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -80.14 139.35 36.86 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 174.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.423 ' HB3' HD11 ' A' ' 80' ' ' LEU . 3.0 tt -69.72 -65.19 0.75 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.961 0.41 . . . . 0.0 110.091 -177.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.423 HD11 ' HB3' ' A' ' 79' ' ' LEU . 6.6 mp -85.64 122.14 29.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.94 0.4 . . . . 0.0 109.96 177.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -94.82 139.66 30.98 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.091 0.472 . . . . 0.0 110.196 178.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.35 -7.71 81.42 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.733 -178.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -121.27 164.2 17.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.456 0.169 . . . . 0.0 110.627 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.441 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 16.0 m170 -128.51 145.12 54.69 Favored Pre-proline 0 CA--C 1.515 -0.4 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.853 173.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . 0.513 ' HB2' ' CE1' ' A' ' 60' ' ' TYR . 20.4 Cg_exo -64.0 135.55 48.23 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.516 2.144 . . . . 0.0 111.823 174.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.604 ' HG3' ' HB3' ' A' ' 97' ' ' GLU . 17.3 ptmt -134.21 146.74 50.4 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.175 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.481 HD12 HG23 ' A' ' 34' ' ' VAL . 98.1 mt -86.92 135.4 33.32 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 120.791 0.329 . . . . 0.0 110.705 -179.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 15.5 m -134.35 139.77 47.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.409 177.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.5 p -77.95 122.44 32.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 173.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -123.14 95.45 4.61 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.959 -171.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.446 ' C ' ' HD2' ' A' ' 92' ' ' ARG . . . 61.6 -106.97 1.31 Allowed Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.466 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.508 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 2.4 mpt_? -111.86 19.63 17.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.03 0.443 . . . . 0.0 110.958 -178.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 13.3 t -145.41 178.68 7.93 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.634 ' HB ' ' OG ' ' A' ' 53' ' ' SER . 75.5 mt -116.33 137.33 50.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 174.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -130.51 177.07 7.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.156 0.503 . . . . 0.0 110.953 -173.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 61.7 mt -118.8 122.62 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.852 -176.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.604 ' HB3' ' HG3' ' A' ' 86' ' ' LYS . 14.4 tt0 -107.74 -176.76 3.15 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.425 178.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.441 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 9.6 m-85 -137.45 134.76 36.19 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 110.529 -0.174 . . . . 0.0 110.529 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.447 ' CD2' ' HB3' ' A' ' 86' ' ' LYS . 53.4 p90 -117.61 160.83 20.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.215 176.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -72.55 126.03 28.87 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.379 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.4 t -51.01 123.04 18.36 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.523 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -56.96 -18.7 29.12 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.306 2.671 . . . . 0.0 113.15 178.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.3 t -74.83 -13.01 15.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.148 0.499 . . . . 0.0 110.769 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 53.3 mmtt . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.819 173.97 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.506 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 30.9 t70 . . . . . 0 C--O 1.232 0.182 0 CA-C-O 121.245 0.545 . . . . 0.0 110.051 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.13 -49.83 72.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.909 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -30.42 69.74 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 121.166 -0.214 . . . . 0.0 110.587 -178.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.506 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 48.8 mtmt -63.51 -50.11 70.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.96 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -72.54 -28.05 62.6 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.769 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 35.3 tp -67.62 -49.98 60.34 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.858 0.361 . . . . 0.0 110.802 178.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -64.93 -32.66 74.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.419 176.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -62.33 -57.38 11.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.409 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.428 ' O ' HG22 ' A' ' 28' ' ' VAL . 26.7 ptm -63.51 -39.04 93.38 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.792 -179.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.583 ' O ' ' HG2' ' A' ' 29' ' ' MET . 19.3 tptp -60.22 -48.85 79.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.457 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -54.08 -50.35 66.99 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.316 176.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.597 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 62.8 mtpt -54.86 -48.35 73.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.615 -176.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.537 ' HA ' HD11 ' A' ' 61' ' ' ILE . 91.3 t -64.63 -46.18 93.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.078 0.466 . . . . 0.0 111.112 -176.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.583 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.2 ptt? -88.08 5.99 38.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.442 0.639 . . . . 0.0 110.463 -171.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.645 ' HD2' ' N ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -102.81 -34.71 8.9 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.087 -0.961 . . . . 0.0 109.875 175.159 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.645 ' N ' ' HD2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -59.42 132.02 52.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.314 -172.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -62.9 -41.93 99.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.939 -172.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -60.1 -39.08 84.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.421 0.629 . . . . 0.0 110.207 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 97.5 t -65.27 -37.93 81.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.663 -179.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 70.9 mm-40 -58.76 -54.09 51.05 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.183 0.516 . . . . 0.0 110.766 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.24 -35.11 76.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.24 -176.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CZ ' HG21 ' A' ' 89' ' ' VAL . 82.0 t80 -71.35 -42.4 68.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.714 178.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.704 HD12 HD11 ' A' ' 50' ' ' ILE . 1.1 mm? -59.31 -43.35 92.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.585 -179.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -79.14 -25.33 42.9 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.607 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -65.41 -54.75 24.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.304 0.573 . . . . 0.0 110.402 177.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -103.01 30.0 5.1 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.359 -174.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -60.46 -32.47 71.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -175.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -69.88 -28.99 66.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.238 0.542 . . . . 0.0 110.478 -177.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.2 t -97.54 -43.86 12.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.605 -176.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.722 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 66.2 mt -72.36 142.56 15.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.534 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -120.5 164.35 16.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.853 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -54.56 -45.0 73.4 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.305 0.574 . . . . 0.0 110.558 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -66.99 -35.83 80.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.616 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.722 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 23.0 ttt -59.91 -36.59 77.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.402 177.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.704 HD11 HD12 ' A' ' 38' ' ' LEU . 44.0 mm -62.74 -50.94 77.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.537 177.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.84 -39.31 93.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.634 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -60.95 -42.81 98.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.175 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.436 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.7 m -107.62 22.98 15.16 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.976 -175.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 25.6 tp -64.9 -26.33 68.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.01 0.433 . . . . 0.0 109.872 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -67.86 -41.23 83.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.166 176.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -67.71 -50.59 56.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.257 176.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 53' ' ' SER . 83.1 mt -58.19 -40.19 80.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.022 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -71.9 -45.88 59.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.29 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.543 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 40.7 tt0 -62.4 -34.79 77.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.369 0.604 . . . . 0.0 110.163 178.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -56.99 -53.27 59.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.295 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.537 HD11 ' HA ' ' A' ' 28' ' ' VAL . 41.9 pt -73.81 -30.6 28.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -174.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.543 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 8.7 pt-20 -78.74 -19.75 51.58 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 120.939 -0.305 . . . . 0.0 111.53 -177.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -73.2 -177.93 2.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.118 0.485 . . . . 0.0 110.964 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.551 ' HB2' ' HB2' ' A' ' 77' ' ' ASN . 13.7 t -71.42 114.17 9.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.217 -177.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -64.59 -44.66 89.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.004 -179.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.413 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 2.3 m-20 -98.47 -163.45 1.04 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.916 177.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.9 p -148.58 157.09 43.22 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.431 ' OG ' ' HB3' ' A' ' 76' ' ' CYS . 2.6 m -62.23 -24.04 67.01 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.324 0.583 . . . . 0.0 111.188 -171.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -62.43 -20.06 64.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.255 177.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.3 p -128.07 -25.54 3.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -176.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.1 p -106.12 -171.91 1.99 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.732 0.301 . . . . 0.0 111.47 -175.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -107.63 17.36 22.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.432 -175.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -69.02 121.46 16.71 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.39 -40.15 27.04 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.043 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -101.97 85.18 2.64 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.102 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.431 ' HB3' ' OG ' ' A' ' 68' ' ' SER . 19.0 p -47.93 114.35 0.9 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.588 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . 0.551 ' HB2' ' HB2' ' A' ' 64' ' ' SER . 75.2 m-20 -87.35 -6.79 58.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.936 175.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -82.06 116.55 21.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.604 176.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.5 tp -61.09 -55.19 35.5 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.5 mp -86.93 87.72 7.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.566 172.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -72.06 148.97 45.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.023 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.54 -9.06 75.07 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 -171.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.439 ' CB ' ' HD2' ' A' ' 98' ' ' TYR . 74.9 m-85 -123.13 168.05 12.89 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.413 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 17.5 m170 -127.95 150.97 75.02 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 172.062 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -74.35 142.5 30.15 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 122.09 1.86 . . . . 0.0 111.391 174.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.507 ' HB3' ' CE1' ' A' ' 99' ' ' TYR . 25.2 pttm -140.31 153.46 46.46 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.9 mt -84.92 142.82 29.4 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.624 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.1 m -136.2 148.63 27.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.077 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.719 HG12 ' HE1' ' A' ' 49' ' ' MET . 4.5 t -103.64 114.12 42.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.355 0.598 . . . . 0.0 110.263 176.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -114.43 96.17 5.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.647 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.82 -112.28 3.88 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.585 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.47 ' C ' ' HE2' ' A' ' 49' ' ' MET . 24.5 mmt180 -117.46 16.09 14.69 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.143 0.497 . . . . 0.0 110.278 176.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 15.3 m -124.18 136.95 54.55 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.147 177.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.455 HG12 HG22 ' A' ' 89' ' ' VAL . 58.2 mt -94.51 135.18 29.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.56 178.61 6.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.077 0.465 . . . . 0.0 110.799 -173.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 69.3 mt -118.94 130.26 74.01 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.291 -176.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.06 176.38 7.06 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.352 -177.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.439 ' HD2' ' CB ' ' A' ' 83' ' ' TYR . 5.0 m-85 -128.71 149.94 50.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.767 0.318 . . . . 0.0 110.736 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.507 ' CE1' ' HB3' ' A' ' 86' ' ' LYS . 51.3 p90 -139.95 152.54 46.42 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.418 ' HG3' ' CE2' ' A' ' 83' ' ' TYR . 2.5 mp0 -61.27 134.2 56.71 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.982 0.42 . . . . 0.0 111.236 -178.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.6 t -53.38 123.21 35.02 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.448 175.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.77 -25.52 79.48 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.829 2.352 . . . . 0.0 112.176 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 50.8 t -67.81 -19.95 25.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.871 179.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 62.4 tttp . . . . . 0 C--N 1.33 -0.248 0 CA-C-O 121.391 0.615 . . . . 0.0 109.882 178.168 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.618 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 2.4 p-10 . . . . . 0 CA--C 1.52 -0.206 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -49.6 -49.58 46.2 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.457 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.09 -33.26 75.37 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.681 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 26.0 mmtp -73.55 -29.44 62.44 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.618 ' HG2' ' O ' ' A' ' 16' ' ' ASP . 13.7 mmm-85 -68.37 -46.47 69.99 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 172.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.7 tp -55.57 -48.88 74.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.116 177.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -65.56 -39.14 91.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.017 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.507 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.9 tp-100 -63.76 -52.1 61.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.764 -177.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.549 ' HE3' HD23 ' A' ' 54' ' ' LEU . 25.8 ptm -66.63 -38.28 86.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.48 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.509 ' HG3' ' HE2' ' A' ' 29' ' ' MET . 49.1 tptt -59.46 -44.22 93.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.178 0.513 . . . . 0.0 109.931 177.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.448 ' HA ' ' HG2' ' A' ' 29' ' ' MET . 33.1 tt0 -67.07 -44.41 80.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.318 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -52.29 -51.01 61.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.215 177.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.468 HG21 ' O ' ' A' ' 24' ' ' MET . 85.5 t -59.06 -41.82 84.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.944 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.509 ' HE2' ' HG3' ' A' ' 25' ' ' LYS . 21.7 ptp -85.52 14.91 4.99 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -176.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -119.45 -2.33 10.58 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 176.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.675 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 29.6 t70 -85.3 135.11 34.05 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.617 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.516 ' HG3' ' N ' ' A' ' 33' ' ' ASP . 5.1 pt20 -63.34 -41.16 98.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.073 -176.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.516 ' N ' ' HG3' ' A' ' 32' ' ' GLN . 11.9 m-20 -74.12 -33.1 63.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.022 0.439 . . . . 0.0 110.001 -175.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.13 -43.9 93.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.047 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.675 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 71.2 mm-40 -56.44 -50.32 72.02 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.269 0.557 . . . . 0.0 110.496 177.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.483 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -56.9 -45.66 82.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.424 -178.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -67.34 -41.35 85.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.136 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.462 HD12 HD12 ' A' ' 50' ' ' ILE . 1.9 mm? -57.82 -43.83 86.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.449 -178.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.538 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.6 ptmm? -82.8 -22.04 34.33 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.753 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 1.1 tm-20 -65.92 -39.56 90.66 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -116.81 32.48 6.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.843 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.538 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 10.7 pt-20 -61.43 -22.5 65.08 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.073 0.463 . . . . 0.0 111.181 -178.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -77.62 -34.63 53.29 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 177.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.3 t -93.29 -39.36 10.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.394 -171.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.529 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 76.1 mt -71.61 142.97 14.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.24 0.543 . . . . 0.0 111.434 -174.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -120.81 166.02 14.34 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.031 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.412 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 57.4 mt-30 -57.69 -44.17 85.63 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.241 0.543 . . . . 0.0 109.963 174.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -63.71 -38.33 90.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.029 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.529 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 50.7 ttm -57.01 -39.16 74.19 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.255 177.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.462 HD12 HD12 ' A' ' 38' ' ' LEU . 45.7 mm -67.27 -42.06 87.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.879 178.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 42.7 mm-40 -66.88 -43.28 83.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.129 0.49 . . . . 0.0 110.417 -178.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -67.57 -30.24 69.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.3 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.486 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.5 m -109.0 19.1 19.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.262 -175.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.549 HD23 ' HE3' ' A' ' 24' ' ' MET . 1.2 mt -59.76 -46.6 88.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.053 0.454 . . . . 0.0 110.427 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -57.73 -39.84 78.24 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.856 176.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.567 ' O ' HD12 ' A' ' 96' ' ' ILE . 4.9 mmpt? -67.66 -51.05 54.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.139 0.495 . . . . 0.0 110.283 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 53' ' ' SER . 90.3 mt -62.24 -41.65 98.61 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.127 -177.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -69.49 -43.97 72.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.414 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.56 ' HG3' ' NE2' ' A' ' 63' ' ' GLN . 11.1 tp10 -56.44 -39.38 73.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.135 0.493 . . . . 0.0 109.892 175.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.433 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 56.2 t80 -56.52 -52.61 64.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.917 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.516 ' HA ' ' HD3' ' A' ' 65' ' ' LYS . 32.9 pt -75.53 -30.57 22.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -77.61 -19.62 55.25 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 111.283 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.56 ' NE2' ' HG3' ' A' ' 59' ' ' GLU . 46.0 mt-30 -78.79 -171.54 2.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.163 0.506 . . . . 0.0 110.756 175.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.2 p -75.64 99.74 4.41 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.423 178.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.516 ' HD3' ' HA ' ' A' ' 61' ' ' ILE . 12.3 mmmm -63.78 -26.49 68.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.206 0.527 . . . . 0.0 110.265 176.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.539 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.5 t-20 -112.63 -165.65 1.01 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.568 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -148.09 154.53 40.33 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.902 178.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.644 ' HA ' ' O ' ' A' ' 71' ' ' SER . 25.6 t -67.78 -20.62 65.22 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.236 -175.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -69.44 -13.67 62.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 111.601 -179.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.539 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 24.6 p -123.33 -33.69 3.22 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.696 -0.401 . . . . 0.0 110.534 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.644 ' O ' ' HA ' ' A' ' 68' ' ' SER . 39.5 m -125.29 103.79 8.13 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -85.66 61.24 6.73 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.904 0.859 . . . . 0.0 110.614 -173.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -85.37 139.42 31.58 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.511 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -86.54 -21.76 26.73 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.656 -174.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -90.28 -34.02 15.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.694 0.283 . . . . 0.0 111.228 -174.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.67 120.41 11.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.109 0.481 . . . . 0.0 111.496 -178.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -77.64 92.89 4.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.538 ' OD1' ' HA ' ' A' ' 81' ' ' GLU . 2.4 t-20 -100.43 117.9 35.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.715 178.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.1 mt -74.06 -74.46 0.19 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.466 -176.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.0 mp -85.57 96.78 9.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 174.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.595 ' HG3' ' HB3' ' A' ' 68' ' ' SER . 30.7 tt0 -72.62 124.71 25.82 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.176 0.512 . . . . 0.0 110.173 -177.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 103.88 -7.74 49.45 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.333 -176.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.561 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 15.5 m-85 -121.37 162.01 21.12 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 178.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.0 m170 -124.68 150.88 66.69 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 173.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . 0.425 ' HB2' ' CD1' ' A' ' 60' ' ' TYR . 55.5 Cg_endo -71.39 141.44 38.81 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.672 2.248 . . . . 0.0 111.536 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.596 ' HB2' ' CD1' ' A' ' 99' ' ' TYR . 86.4 tttt -131.47 131.14 43.27 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.568 -172.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.76 125.98 33.65 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.254 177.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.498 HG11 ' HG3' ' A' ' 97' ' ' GLU . 29.5 m -131.26 145.21 35.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.668 0.271 . . . . 0.0 110.882 178.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.4 p -95.52 120.42 44.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.259 0.552 . . . . 0.0 110.024 176.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -121.96 96.3 5.0 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.866 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.65 -104.31 1.59 Allowed Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.151 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.414 ' HA ' ' HE2' ' A' ' 49' ' ' MET . 5.5 mmp_? -116.57 5.71 13.34 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.565 0.221 . . . . 0.0 111.175 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.1 p -130.01 159.86 35.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.975 0.417 . . . . 0.0 111.35 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.9 mt -110.28 137.9 40.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.92 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.486 ' HA ' ' HD3' ' A' ' 56' ' ' LYS . 1.8 t0 -126.97 178.92 5.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.879 0.371 . . . . 0.0 110.63 -175.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.567 HD12 ' O ' ' A' ' 56' ' ' LYS . 44.8 mt -123.1 112.61 34.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.195 -176.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.498 ' HG3' HG11 ' A' ' 88' ' ' VAL . 3.7 mm-40 -98.61 -175.11 2.98 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.272 174.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.561 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 3.3 m-85 -139.67 124.03 18.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 174.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.596 ' CD1' ' HB2' ' A' ' 86' ' ' LYS . 39.0 p90 -110.41 147.02 34.85 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 176.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.454 ' H ' ' CD ' ' A' ' 100' ' ' GLU . 2.3 pm0 -66.44 135.06 53.73 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.478 0.656 . . . . 0.0 110.713 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.437 ' SG ' HG12 ' A' ' 103' ' ' VAL . 21.3 t -44.52 124.67 4.75 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 114.195 -1.366 . . . . 0.0 111.857 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -59.32 -10.23 10.34 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 123.339 2.693 . . . . 0.0 113.435 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.437 HG12 ' SG ' ' A' ' 101' ' ' CYS . 8.7 p -66.57 -18.33 23.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.035 0.445 . . . . 0.0 110.625 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.425 ' HD2' ' HA ' ' A' ' 104' ' ' LYS . 13.1 mmmm . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.894 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.428 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 11.4 m-20 . . . . . 0 CA--C 1.522 -0.131 0 CA-C-O 120.478 0.18 . . . . 0.0 111.263 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.81 -51.71 67.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.142 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.66 -31.18 68.01 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.313 -177.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.1 mtpp -66.59 -48.77 68.49 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.966 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.512 ' O ' ' HG2' ' A' ' 24' ' ' MET . 7.2 ptm180 -68.47 -31.69 71.16 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 37.2 tp -62.86 -50.28 71.53 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -59.66 -45.13 92.95 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 120.952 0.406 . . . . 0.0 110.31 176.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -59.1 -57.76 11.62 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.385 -175.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.512 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 25.3 ptm -66.74 -38.3 86.39 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.39 -177.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.533 ' HE2' ' HE3' ' A' ' 29' ' ' MET . 17.0 tptm -64.81 -41.46 95.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.004 0.431 . . . . 0.0 110.292 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.515 ' HG3' ' HD3' ' A' ' 30' ' ' LYS . 23.4 tt0 -61.83 -50.63 71.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.557 177.004 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -54.41 -42.27 70.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.303 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 24' ' ' MET . 87.0 t -68.87 -42.75 82.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.968 0.413 . . . . 0.0 110.953 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.533 ' HE3' ' HE2' ' A' ' 25' ' ' LYS . 44.4 mtt -78.69 -6.93 57.09 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -175.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.515 ' HD3' ' HG3' ' A' ' 26' ' ' GLU . 2.1 mptm? -103.26 -4.08 24.78 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -178.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.689 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 25.2 t70 -83.41 134.0 34.9 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.843 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -66.25 -41.34 90.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.851 -175.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -74.32 -35.49 63.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.776 0.322 . . . . 0.0 110.393 -174.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.8 t -55.67 -47.65 78.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.774 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.689 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 35.1 mt-30 -65.02 -31.75 73.13 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.155 0.502 . . . . 0.0 110.88 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.34 -46.49 88.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.464 176.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -65.52 -42.35 92.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.407 176.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.435 HD12 ' HA ' ' A' ' 38' ' ' LEU . 1.8 mm? -57.36 -44.43 84.35 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.703 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -73.75 -28.18 61.55 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.923 -177.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -66.47 -55.71 14.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.619 0.723 . . . . 0.0 110.474 178.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -102.47 30.23 4.74 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.627 -174.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -60.4 -27.41 67.43 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.124 -177.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -85.79 -24.1 26.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.885 0.374 . . . . 0.0 111.122 -179.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 22.0 t -93.4 -35.15 6.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.277 0.56 . . . . 0.0 111.147 -172.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.524 HG23 ' HE3' ' A' ' 49' ' ' MET . 50.7 mt -88.27 150.99 3.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.522 -178.004 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -119.34 163.2 17.53 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 29.9 mm-40 -59.61 -39.06 82.98 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.606 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -64.52 -38.05 89.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.045 0.45 . . . . 0.0 110.554 178.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.524 ' HE3' HG23 ' A' ' 45' ' ' ILE . 2.1 ttp -67.43 -31.93 72.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.224 178.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.0 mm -63.69 -46.39 94.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.256 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 9.7 mm-40 -67.37 -40.46 85.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.74 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -66.68 -43.52 84.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.02 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.6 m -98.98 19.31 15.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.002 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 42.8 tp -63.06 -30.12 71.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -61.83 -38.08 86.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.02 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 17.1 mmtm -74.95 -40.64 60.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.321 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.09 -41.06 97.8 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.331 0.586 . . . . 0.0 110.167 175.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -69.62 -44.47 70.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.539 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.543 ' HG2' ' NE2' ' A' ' 63' ' ' GLN . 45.3 tt0 -64.13 -35.4 80.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.344 178.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.542 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 26.3 t80 -56.15 -56.1 25.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.369 177.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.1 pt -69.31 -30.99 47.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.09 -174.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.464 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 11.0 pt-20 -80.53 -24.97 38.95 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.142 -0.623 . . . . 0.0 112.241 -174.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.543 ' NE2' ' HG2' ' A' ' 59' ' ' GLU . 49.7 mt-30 -77.76 -32.4 52.6 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.833 -176.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.441 ' OG ' ' HB2' ' A' ' 78' ' ' ASN . 10.9 m -178.84 118.37 0.07 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.047 -175.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.71 -51.79 6.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.8 0.81 . . . . 0.0 109.088 169.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.523 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 30.7 p30 -115.71 -157.81 0.66 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.948 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.474 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 8.2 p -152.62 163.55 39.41 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 44.4 t -54.92 -31.13 59.94 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 123.829 0.706 . . . . 0.0 111.286 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.443 ' HB2' ' HA2' ' A' ' 82' ' ' GLY . 0.1 OUTLIER -75.36 4.97 6.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.286 -0.416 . . . . 0.0 112.036 -178.656 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.9 p -151.64 19.25 0.71 Allowed 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.141 0.496 . . . . 0.0 110.352 175.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.6 t -129.65 153.38 48.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.414 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.5 tp10 -77.44 -27.1 52.05 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -84.6 129.25 34.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.349 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.96 -4.86 5.06 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.564 174.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -75.51 -40.56 56.93 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.209 -175.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 26.4 p -152.07 26.18 0.62 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.866 0.365 . . . . 0.0 110.934 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -68.89 -60.44 2.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.253 -173.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.474 ' OD1' ' HA ' ' A' ' 67' ' ' CYS . 1.3 p-10 -160.97 156.98 25.61 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.28 -0.418 . . . . 0.0 109.928 -177.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -74.06 -56.81 4.48 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.789 0.328 . . . . 0.0 111.161 -174.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 29.1 mt -82.29 81.25 8.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.43 0.633 . . . . 0.0 111.058 -176.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -64.59 129.34 39.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.767 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . 0.443 ' HA2' ' HB2' ' A' ' 69' ' ' TYR . . . 97.52 -9.02 64.47 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.346 178.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.714 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 44.7 m-85 -125.0 157.93 34.94 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 111.394 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.523 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 12.5 m170 -129.61 155.29 80.51 Favored Pre-proline 0 CA--C 1.51 -0.59 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 171.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . 0.542 ' O ' ' HE1' ' A' ' 60' ' ' TYR . 38.2 Cg_endo -77.81 151.61 28.17 Favored 'Trans proline' 0 N--CA 1.446 -1.318 0 C-N-CA 122.096 1.864 . . . . 0.0 110.717 172.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.457 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 31.5 ttpt -144.83 141.35 29.07 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 176.274 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -78.7 140.01 38.4 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 32.2 m -132.26 147.84 32.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 175.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 p -98.17 114.4 35.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.406 0.622 . . . . 0.0 110.298 178.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -117.42 96.32 5.35 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.556 178.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.83 -107.38 2.07 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.066 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -116.96 19.16 14.46 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.218 0.533 . . . . 0.0 110.482 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.8 p -135.42 141.77 45.5 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.234 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.1 mt -96.54 131.84 42.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.116 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -120.48 178.13 4.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.636 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 70.8 mt -132.93 114.53 22.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.851 0.357 . . . . 0.0 110.934 -176.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 9.4 pt-20 -103.13 -177.05 3.26 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.714 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 2.9 m-85 -130.25 123.61 30.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.107 0.48 . . . . 0.0 110.587 175.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.457 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 51.2 p90 -112.75 151.88 29.77 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 176.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.408 ' HA ' ' HA ' ' A' ' 83' ' ' TYR . 5.4 pt-20 -84.42 133.26 34.51 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.744 0.783 . . . . 0.0 111.467 -178.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.502 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 6.6 t -46.8 123.49 7.65 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.803 -178.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.93 -10.79 29.7 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.801 2.334 . . . . 0.0 112.442 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 59.6 t -69.0 -20.44 24.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.925 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' A' ' 101' ' ' CYS . 22.3 ptmt . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.683 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 120.682 0.277 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -54.58 -56.16 21.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.685 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.517 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 2.9 pt20 -71.5 -30.29 65.79 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.733 -177.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.4 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 29.9 mtpp -59.01 -47.92 83.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.533 178.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -77.49 -29.98 52.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.694 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.517 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 23.5 tp -61.1 -50.02 74.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.899 179.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -75.68 -27.2 58.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.097 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 34.1 tt0 -62.25 -54.87 34.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.931 0.396 . . . . 0.0 110.551 178.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.675 ' HE2' HD11 ' A' ' 54' ' ' LEU . 25.3 ptm -65.67 -36.99 85.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.025 177.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 11.7 tptm -54.3 -49.33 69.91 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.695 175.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -60.14 -48.3 82.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.996 -175.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -57.34 -40.3 77.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.111 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.455 HG21 ' O ' ' A' ' 24' ' ' MET . 60.7 t -70.96 -33.89 53.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.168 0.509 . . . . 0.0 110.393 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.5 mmt -71.03 -14.01 62.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.125 -176.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.77 14.51 12.56 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.683 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 18.3 t70 -85.31 135.48 33.89 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.549 176.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -63.99 -47.31 80.84 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.83 -175.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -70.48 -34.04 71.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.893 0.377 . . . . 0.0 110.405 -175.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 76.4 t -58.59 -43.23 86.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.761 174.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.683 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 61.9 mm-40 -59.59 -49.06 79.22 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.171 0.51 . . . . 0.0 110.527 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.52 -43.48 75.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.609 -177.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.511 ' CE2' HD12 ' A' ' 45' ' ' ILE . 78.3 t80 -72.28 -40.98 67.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.057 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.91 HD11 HD12 ' A' ' 50' ' ' ILE . 1.9 mm? -60.11 -45.54 92.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.538 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -73.71 -26.15 60.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.536 -178.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -66.35 -54.92 18.97 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.384 0.612 . . . . 0.0 110.307 176.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -105.69 32.64 4.2 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.483 -173.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -62.43 -24.45 67.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.944 0.402 . . . . 0.0 111.178 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -68.5 -36.42 78.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.336 0.588 . . . . 0.0 110.011 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 15.4 t -93.9 -43.21 13.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.83 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.511 HD12 ' CE2' ' A' ' 37' ' ' PHE . 67.9 mt -75.63 144.21 12.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.864 -176.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -131.25 176.72 8.04 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.405 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 99.3 mt-30 -59.74 -39.93 86.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.763 0.316 . . . . 0.0 111.82 -177.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -72.8 -36.8 67.66 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.935 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.584 ' HE2' ' HA ' ' A' ' 92' ' ' ARG . 53.6 ttm -56.47 -36.58 69.25 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 174.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.91 HD12 HD11 ' A' ' 38' ' ' LEU . 37.2 mm -61.48 -54.71 31.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.996 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.575 ' HA ' HD22 ' A' ' 54' ' ' LEU . 29.7 mt-10 -68.82 -34.6 75.78 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -178.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.4 tptp -65.02 -26.54 68.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.906 0.384 . . . . 0.0 110.525 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -115.2 16.36 16.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.38 -178.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.675 HD11 ' HE2' ' A' ' 24' ' ' MET . 0.1 OUTLIER -58.83 -41.16 86.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.613 -178.685 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -55.48 -43.77 75.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.436 176.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.496 ' O ' HD12 ' A' ' 96' ' ' ILE . 33.2 mmtp -71.49 -48.38 49.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.861 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.57 -42.26 87.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.034 0.445 . . . . 0.0 110.753 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -70.08 -39.44 75.59 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.423 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.01 -40.13 92.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.038 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.45 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 70.0 t80 -63.25 -50.49 69.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.979 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.1 pt -70.28 -31.27 46.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -171.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -85.38 -25.67 26.92 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.335 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 0.8 OUTLIER -75.06 160.99 29.83 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.603 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.9 p -64.1 120.52 12.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.696 0.284 . . . . 0.0 111.39 -176.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.451 ' HD3' ' O ' ' A' ' 65' ' ' LYS . 3.0 tmtp? -73.64 -31.74 63.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.526 0.679 . . . . 0.0 109.168 177.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -84.73 -165.4 1.17 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.215 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 p -157.8 159.85 37.17 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 176.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.449 ' HB2' ' HB2' ' A' ' 76' ' ' CYS . 22.8 t -67.42 -23.43 65.55 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.054 0.454 . . . . 0.0 110.509 -172.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -68.1 -9.09 43.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.696 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.2 p -133.42 1.24 3.42 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 28.8 m -122.64 140.51 52.75 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -81.09 57.3 3.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.928 0.87 . . . . 0.0 110.407 -177.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -154.32 124.71 6.95 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.231 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -100.35 0.16 39.47 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.357 -176.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -88.45 53.24 2.66 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 78' ' ' ASN . 49.7 t -84.55 129.98 34.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.59 -1.187 . . . . 0.0 111.154 -172.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -80.13 -17.42 52.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.001 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.451 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 39.0 t30 -57.97 136.86 57.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.508 -177.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.7 mt -81.86 -56.52 3.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.859 -179.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.405 ' HB2' ' CE2' ' A' ' 98' ' ' TYR . 3.9 mm? -85.34 79.36 9.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.715 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -73.5 138.71 45.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.562 0.696 . . . . 0.0 110.67 -176.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.55 -8.58 68.91 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.956 -171.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.439 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 74.4 m-85 -122.78 168.91 11.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 178.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.403 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 15.7 m170 -128.41 149.12 70.69 Favored Pre-proline 0 C--O 1.236 0.383 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 170.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -70.74 142.67 44.14 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.78 2.32 . . . . 0.0 112.866 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.472 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 16.6 ttmm -133.48 137.19 45.55 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.179 177.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.1 mt -83.66 130.63 34.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.198 176.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.43 HG23 ' HG2' ' A' ' 97' ' ' GLU . 16.0 m -132.11 149.86 33.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.48 178.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.6 p -97.64 118.03 43.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.201 0.524 . . . . 0.0 110.697 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -122.31 98.04 5.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.014 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.53 -112.01 4.58 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.995 -177.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.584 ' HA ' ' HE2' ' A' ' 49' ' ' MET . 17.7 mmt180 -112.6 15.49 20.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.155 0.503 . . . . 0.0 110.512 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.9 p -125.78 131.12 52.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.075 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.5 mt -91.04 129.16 42.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -119.27 177.83 4.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.952 0.406 . . . . 0.0 110.847 -170.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.496 HD12 ' O ' ' A' ' 56' ' ' LYS . 56.5 mt -127.7 106.87 15.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.587 -177.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.43 ' HG2' HG23 ' A' ' 88' ' ' VAL . 57.3 mm-40 -97.31 178.9 5.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.433 176.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.405 ' CE2' ' HB2' ' A' ' 80' ' ' LEU . 24.4 m-85 -132.16 130.71 41.45 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.159 0.504 . . . . 0.0 111.12 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.472 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 38.0 p90 -113.41 150.87 32.1 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.381 174.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.439 ' HG2' ' CE1' ' A' ' 83' ' ' TYR . 36.8 mt-10 -64.62 131.48 47.1 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.657 0.265 . . . . 0.0 110.907 -177.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.504 ' SG ' HG12 ' A' ' 103' ' ' VAL . 47.7 t -44.63 122.56 4.54 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.889 177.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.53 -12.67 21.82 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 123.241 2.627 . . . . 0.0 113.849 -175.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.504 HG12 ' SG ' ' A' ' 101' ' ' CYS . 4.5 p -67.77 -19.02 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 120.765 0.316 . . . . 0.0 110.525 178.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.2 mttt . . . . . 0 C--O 1.231 0.109 0 CA-C-O 121.068 0.461 . . . . 0.0 110.515 177.19 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.517 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 2.1 p-10 . . . . . 0 C--O 1.232 0.165 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -55.48 -53.06 61.06 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.539 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -63.66 -31.23 72.33 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.888 -177.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.517 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 43.1 mtmt -64.36 -36.67 84.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.576 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.466 ' O ' ' HG2' ' A' ' 24' ' ' MET . 8.6 mtt180 -71.77 -50.65 28.05 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.457 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.8 tp -54.21 -49.64 68.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.049 -175.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -74.67 -34.58 62.71 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.97 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 8.2 tt0 -63.44 -56.19 18.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.777 0.323 . . . . 0.0 110.862 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.582 ' O ' HG21 ' A' ' 28' ' ' VAL . 25.4 ptm -61.7 -37.64 84.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.747 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.537 ' HA ' ' HE3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -66.93 -44.55 80.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.154 178.707 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -65.03 -37.21 86.86 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -58.06 -44.16 87.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.698 175.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.582 HG21 ' O ' ' A' ' 24' ' ' MET . 78.1 t -64.62 -36.08 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.956 178.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.446 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 88.9 mmm -84.97 0.14 52.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.071 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.87 -35.99 13.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.436 0.636 . . . . 0.0 110.331 175.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.68 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 21.7 t70 -62.56 123.49 18.48 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.154 -171.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.65 -41.25 94.6 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.395 -176.547 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.462 ' CB ' ' HZ2' ' A' ' 65' ' ' LYS . 5.6 t0 -63.12 -46.85 85.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.918 -177.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.8 t -54.93 -47.11 76.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.404 176.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.68 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 55.5 mt-30 -62.31 -40.63 96.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.5 -176.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.54 -40.26 82.49 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.562 177.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.437 ' CE2' HD13 ' A' ' 45' ' ' ILE . 88.5 t80 -69.56 -39.79 77.18 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.397 177.274 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.554 HD13 HD11 ' A' ' 50' ' ' ILE . 2.6 mm? -63.08 -44.91 94.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.756 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -68.51 -29.12 67.65 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.104 0.478 . . . . 0.0 110.527 -177.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.47 -30.42 37.43 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.987 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -119.14 26.55 9.41 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -65.4 -17.64 64.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.097 0.475 . . . . 0.0 110.18 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.84 -31.76 69.81 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.118 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.5 t -108.19 -35.43 2.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.492 -172.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.437 HD13 ' CE2' ' A' ' 37' ' ' PHE . 68.9 mt -78.3 135.67 25.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.558 0.694 . . . . 0.0 111.516 -175.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -111.44 164.98 12.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.74 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -61.51 -37.23 82.94 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.347 0.594 . . . . 0.0 109.658 173.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.596 ' HB3' ' HZ3' ' A' ' 48' ' ' LYS . 1.9 mmmp? -63.07 -42.2 99.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.276 178.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 33.6 tpp -56.21 -42.29 76.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.289 176.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.554 HD11 HD13 ' A' ' 38' ' ' LEU . 35.9 mm -60.32 -39.35 80.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.517 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.51 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 41.8 mt-10 -65.58 -49.19 69.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.487 176.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.508 ' HE2' ' HA ' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -60.65 -47.16 87.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.14 -177.027 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.3 p -92.79 17.66 10.1 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.329 -175.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.51 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -52.45 -49.37 64.76 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.96 0.409 . . . . 0.0 110.786 -179.473 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -61.74 -42.32 98.81 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.681 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -61.15 -51.36 69.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.806 0.336 . . . . 0.0 110.388 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.411 HD11 ' HA ' ' A' ' 57' ' ' LEU . 3.9 mm? -59.95 -43.31 95.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.054 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -66.21 -42.62 88.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.411 -177.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -59.59 -36.43 76.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.352 0.596 . . . . 0.0 110.021 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -67.23 -45.38 76.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.885 -178.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.6 pt -75.36 -31.4 23.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -174.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -81.07 -27.05 35.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.589 0.233 . . . . 0.0 111.29 -177.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -80.25 173.99 12.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.055 0.455 . . . . 0.0 111.117 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.6 m -76.7 116.04 17.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.704 -179.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.462 ' HZ2' ' CB ' ' A' ' 33' ' ' ASP . 90.6 mttt -81.02 -35.76 31.47 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.129 0.49 . . . . 0.0 110.111 176.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -79.86 -177.02 5.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.952 177.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -150.79 156.81 42.02 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.632 -177.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.474 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 33.1 t -66.98 -19.01 65.65 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.223 -172.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.47 ' CE1' ' HA ' ' A' ' 104' ' ' LYS . 1.2 t80 -75.9 -2.23 29.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.066 0.46 . . . . 0.0 111.305 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 17.6 p -132.24 -44.28 0.94 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.559 176.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.6 p -80.53 152.09 28.84 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -81.97 -9.79 59.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.818 0.342 . . . . 0.0 110.768 -176.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . 0.449 ' HB2' ' HB2' ' A' ' 76' ' ' CYS . 7.4 m-20 -55.0 111.82 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.222 -175.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -70.4 -21.74 62.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.449 0.643 . . . . 0.0 109.273 171.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -86.98 4.84 40.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.563 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 73' ' ' ASP . 45.8 t -69.3 114.37 7.48 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.07 0.462 . . . . 0.0 110.506 -178.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -117.22 143.85 45.43 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -160.49 168.41 25.15 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.0 mt -75.26 -79.22 0.1 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.0 mp -88.34 93.86 9.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.206 173.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.474 ' CD ' ' H ' ' A' ' 68' ' ' SER . 2.2 mm-40 -76.19 151.52 36.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.354 0.597 . . . . 0.0 110.714 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.38 -9.74 72.01 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.028 -170.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.543 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 64.9 m-85 -122.47 172.12 8.59 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.477 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 14.5 m170 -128.92 144.35 52.19 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 172.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -75.34 130.76 13.22 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.446 2.097 . . . . 0.0 111.252 174.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.555 ' HD3' ' CD1' ' A' ' 99' ' ' TYR . 19.9 pttp -134.99 148.5 49.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.007 0.432 . . . . 0.0 109.994 175.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 73.2 mt -81.26 141.62 33.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.346 -175.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.7 m -135.95 154.23 33.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.562 175.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.6 p -107.05 114.02 45.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.343 0.592 . . . . 0.0 110.346 176.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -125.89 101.97 7.07 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.302 -177.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.73 -118.5 9.86 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.211 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.476 ' O ' ' HG3' ' A' ' 92' ' ' ARG . 20.7 tpp180 -105.2 19.52 20.45 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.978 0.894 . . . . 0.0 109.947 -179.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 43.3 t -136.16 136.53 40.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.25 0.548 . . . . 0.0 111.433 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 86.3 mt -89.61 119.54 36.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 169.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.57 177.71 4.54 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.852 0.358 . . . . 0.0 110.634 -172.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 53.3 mt -131.64 115.98 29.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.309 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -119.03 163.28 17.21 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 174.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.543 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 30.3 m-85 -103.92 141.21 36.55 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.096 -176.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.555 ' CD1' ' HD3' ' A' ' 86' ' ' LYS . 53.6 p90 -117.69 147.55 42.81 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 173.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.462 ' HG2' ' CE2' ' A' ' 83' ' ' TYR . 31.5 mt-10 -62.58 125.83 25.27 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.395 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.587 ' HB3' ' HB2' ' A' ' 104' ' ' LYS . 40.0 t -47.31 132.43 9.82 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.235 175.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -55.58 -29.29 69.26 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 122.537 2.158 . . . . 0.0 112.085 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.0 t -80.16 -17.9 12.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.38 178.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.587 ' HB2' ' HB3' ' A' ' 101' ' ' CYS . 14.2 tmtt? . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.524 -179.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.707 0.289 . . . . 0.0 110.892 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -55.85 -50.54 70.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.395 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -34.3 70.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.895 0.378 . . . . 0.0 110.184 -176.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -62.47 -47.63 83.14 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.776 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.512 ' O ' ' HG2' ' A' ' 24' ' ' MET . 12.7 ptm180 -72.57 -32.34 65.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.563 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.617 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 36.4 tp -64.85 -50.28 67.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.152 -178.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -67.02 -29.92 69.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.272 0.558 . . . . 0.0 110.309 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -67.69 -54.75 16.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.5 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.512 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 25.7 ptm -68.66 -34.63 76.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.068 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.617 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 12.3 tptm -56.69 -51.79 67.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.312 0.577 . . . . 0.0 110.308 178.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.471 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 41.2 tt0 -65.41 -36.33 83.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.647 -179.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.7 mtpp -62.94 -36.45 83.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.731 178.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 24' ' ' MET . 95.9 t -70.73 -38.55 73.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.178 0.513 . . . . 0.0 109.738 177.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 25.9 mmt -77.36 5.27 9.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.042 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.471 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 1.9 mptp? -101.53 -13.7 17.78 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.775 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.665 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 35.5 t70 -85.6 142.59 29.0 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.257 0.551 . . . . 0.0 111.927 -172.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -72.48 -44.2 62.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.463 -176.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -67.8 -38.56 83.46 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 -178.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.416 ' O ' HD21 ' A' ' 38' ' ' LEU . 46.2 t -53.71 -46.54 62.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.873 175.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.665 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 59.0 mm-40 -57.92 -52.36 65.8 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.048 0.451 . . . . 0.0 110.852 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.46 97.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.516 -176.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.1 t80 -63.71 -40.05 95.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.635 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.537 HD12 HD11 ' A' ' 50' ' ' ILE . 2.2 mm? -62.13 -49.32 76.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.371 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -66.71 -28.09 68.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.249 0.547 . . . . 0.0 110.804 -177.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.44 -33.33 54.82 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.563 -178.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -119.16 25.67 10.0 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.393 -175.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -70.0 -17.02 63.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.636 0.255 . . . . 0.0 111.616 -175.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -71.79 -39.89 69.58 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.1 t -93.41 -41.44 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.737 -172.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.482 HG12 ' SD ' ' A' ' 49' ' ' MET . 64.9 mt -92.92 141.74 14.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.029 -176.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.473 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -131.54 -179.21 5.23 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.12 -36.85 80.84 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.539 0.2 . . . . 0.0 111.539 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -62.27 -48.74 78.6 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.482 ' SD ' HG12 ' A' ' 45' ' ' ILE . 44.5 ttm -60.1 -35.97 76.38 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.774 178.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.537 HD11 HD12 ' A' ' 38' ' ' LEU . 36.6 mm -63.53 -47.8 89.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.056 178.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -70.37 -30.56 67.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.951 0.405 . . . . 0.0 110.766 -178.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.472 ' N ' ' HE3' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -75.49 -40.9 56.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.041 179.189 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.426 ' HB2' HD12 ' A' ' 94' ' ' ILE . 15.4 m -95.87 21.3 8.74 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.475 178.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.2 tp -59.13 -40.75 86.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.408 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -59.68 -41.55 90.94 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.363 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.484 ' O ' HD13 ' A' ' 96' ' ' ILE . 73.7 mmtt -64.01 -53.44 49.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.759 178.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.414 HD13 HG23 ' A' ' 94' ' ' ILE . 11.0 mp -61.06 -39.12 88.66 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.151 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -67.49 -40.95 85.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.774 179.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -64.49 -37.8 88.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.342 0.591 . . . . 0.0 109.9 177.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.493 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 54.9 t80 -65.33 -47.1 77.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.162 -177.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.525 ' HA ' ' HE3' ' A' ' 65' ' ' LYS . 23.7 pt -70.32 -30.51 43.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 C-N-CA 121.148 -0.221 . . . . 0.0 111.508 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -81.34 -25.19 36.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.795 -179.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 2.2 pt20 -82.51 156.0 24.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.693 -178.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 14.5 m -62.48 109.46 1.38 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.455 -177.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.525 ' HE3' ' HA ' ' A' ' 61' ' ' ILE . 93.7 mttt -83.26 -41.0 18.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.911 178.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -78.75 171.53 15.02 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.167 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -141.16 154.01 45.65 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -178.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.539 ' HB2' ' OE2' ' A' ' 81' ' ' GLU . 72.5 m -74.31 -11.45 60.27 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.507 0.504 . . . . 0.0 111.442 -170.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.21 -0.43 19.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.001 174.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 28.6 p -143.67 -28.19 0.53 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.761 176.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.48 ' O ' ' HA ' ' A' ' 68' ' ' SER . 16.5 m -114.16 151.19 33.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -100.31 7.36 44.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.585 0.231 . . . . 0.0 111.211 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.13 104.36 0.14 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.369 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -83.01 -23.92 33.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.821 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -92.73 29.68 1.72 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.492 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 31.1 p -134.4 126.62 29.93 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 174.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -83.38 120.89 26.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.302 0.572 . . . . 0.0 109.834 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -111.06 109.83 20.1 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.316 0.579 . . . . 0.0 109.879 174.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.5 tt -57.65 -61.41 2.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.108 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.2 mp -86.47 162.95 17.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.574 173.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.539 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 6.8 tp10 -141.07 145.57 36.01 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.93 6.92 87.51 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -169.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.645 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 78.5 m-85 -134.51 154.98 51.16 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.76 0.314 . . . . 0.0 110.881 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.8 m170 -130.48 146.07 60.18 Favored Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 174.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . 0.448 ' CG ' ' HA ' ' A' ' 65' ' ' LYS . 69.7 Cg_endo -78.05 143.16 20.15 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.191 1.927 . . . . 0.0 111.82 174.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -144.15 150.74 38.54 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 176.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 97.5 mt -75.75 137.57 40.67 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.025 176.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.446 HG21 ' OE2' ' A' ' 97' ' ' GLU . 30.2 m -130.58 148.52 33.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 116.28 -0.418 . . . . 0.0 109.931 177.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.3 p -87.87 116.27 29.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.555 0.693 . . . . 0.0 109.551 175.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.31 95.88 5.28 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.098 -176.051 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.81 -108.31 2.33 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.849 -176.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -117.67 19.29 13.92 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.306 0.574 . . . . 0.0 109.985 177.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 11.6 p -132.48 160.49 36.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.003 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.426 HD12 ' HB2' ' A' ' 53' ' ' SER . 47.1 mt -104.67 134.65 45.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -125.49 178.14 5.8 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -175.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.484 HD13 ' O ' ' A' ' 56' ' ' LYS . 26.9 mt -130.83 113.71 25.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.882 -178.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.446 ' OE2' HG21 ' A' ' 88' ' ' VAL . 32.8 mt-10 -126.85 159.38 34.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.585 -0.279 . . . . 0.0 110.287 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.645 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 8.0 m-85 -99.31 136.08 39.78 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.981 0.42 . . . . 0.0 112.026 -175.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -115.19 158.62 22.01 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 173.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.91 139.37 43.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.749 0.309 . . . . 0.0 110.614 -175.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 33.0 t -55.07 121.82 38.42 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.117 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.61 -9.25 25.56 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.374 2.05 . . . . 0.0 112.576 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 33.4 t -82.01 -13.53 12.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.182 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.9 tptp . . . . . 0 C--N 1.324 -0.504 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.85 -178.354 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.928 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 9.9 t70 . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 120.584 0.23 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -53.26 -55.97 20.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.485 178.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.55 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 2.3 pt20 -66.17 -31.22 71.94 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.739 0.304 . . . . 0.0 110.761 -177.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.928 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 50.4 mtpt -58.27 -42.12 85.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.388 177.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.691 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 23.2 mtp180 -78.8 -41.36 30.54 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.902 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.55 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 30.1 tp -54.27 -49.75 68.85 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.737 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -75.92 -28.52 58.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.018 0.437 . . . . 0.0 110.759 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 7.7 tt0 -62.41 -55.27 29.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.913 176.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.466 ' O ' HG21 ' A' ' 28' ' ' VAL . 27.1 ptm -62.99 -35.86 81.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.755 -179.194 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.66 ' O ' ' HG2' ' A' ' 29' ' ' MET . 4.1 tppp? -55.82 -53.86 51.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 173.119 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.627 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 2.3 tt0 -55.07 -48.16 73.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.651 178.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.442 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 12.5 mmmt -51.84 -42.23 62.43 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.064 178.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.533 ' HA ' HD11 ' A' ' 61' ' ' ILE . 78.6 t -69.89 -37.61 73.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 121.212 0.53 . . . . 0.0 110.3 -177.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.66 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 29.1 mmm -75.23 5.82 5.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.557 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.627 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 30.5 mmtp -102.81 -18.27 15.19 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.645 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 23.1 t70 -81.27 129.28 34.54 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.731 -0.388 . . . . 0.0 111.142 -175.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -62.66 -36.58 83.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.826 -0.624 . . . . 0.0 112.2 -175.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -73.74 -36.75 65.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.834 0.35 . . . . 0.0 110.402 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 32.8 t -57.72 -50.09 78.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.406 173.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.645 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 45.8 mt-30 -61.32 -41.29 96.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.577 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -58.86 -40.84 85.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.67 177.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -67.79 -41.39 83.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.765 177.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.503 HD12 HD12 ' A' ' 50' ' ' ILE . 1.9 mm? -60.75 -45.37 94.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.366 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -72.87 -25.1 60.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.01 0.433 . . . . 0.0 110.797 -178.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -78.85 -32.13 45.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.683 -177.512 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -122.73 28.33 7.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.278 -178.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -62.84 -23.86 67.5 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.935 0.398 . . . . 0.0 111.43 -178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -70.79 -32.95 70.22 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.289 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.9 t -94.74 -44.53 13.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.926 -172.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.6 mt -79.8 142.87 13.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.328 -174.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -127.95 176.3 7.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.423 175.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.553 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 49.1 mt-30 -58.77 -46.4 87.57 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -177.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -60.01 -40.0 87.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.756 0.312 . . . . 0.0 111.297 -178.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.479 ' HG2' HG13 ' A' ' 94' ' ' ILE . 44.1 ttm -60.06 -43.39 95.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.476 177.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.503 HD12 HD12 ' A' ' 38' ' ' LEU . 38.2 mm -62.79 -44.71 99.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.061 178.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 13.7 mm-40 -61.89 -36.42 81.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.595 -177.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.9 mtmt -75.31 -44.17 46.92 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.793 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.485 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 26.0 m -91.93 19.65 6.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.588 -174.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.457 ' HG ' ' HE3' ' A' ' 24' ' ' MET . 45.9 tp -62.47 -37.9 87.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.853 0.358 . . . . 0.0 110.317 178.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -62.18 -39.99 94.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.352 176.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.56 ' O ' HD12 ' A' ' 96' ' ' ILE . 70.2 mmtt -61.53 -53.32 57.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.1 0.476 . . . . 0.0 110.885 178.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.16 -36.58 84.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.354 -177.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -69.58 -42.42 74.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.796 0.331 . . . . 0.0 110.157 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -56.18 -42.8 77.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.965 175.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.475 ' HA ' HE21 ' A' ' 63' ' ' GLN . 76.2 t80 -61.52 -46.97 87.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.418 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.533 HD11 ' HA ' ' A' ' 28' ' ' VAL . 36.2 pt -75.38 -31.14 23.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 -175.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -84.1 -19.33 34.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.762 0.315 . . . . 0.0 111.078 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.475 HE21 ' HA ' ' A' ' 60' ' ' TYR . 24.7 pt20 -88.08 -178.05 5.88 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 173.454 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.0 m -71.75 124.62 25.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.118 0.485 . . . . 0.0 111.345 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -78.17 -27.09 47.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.922 174.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.539 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 79.0 m-20 -99.92 -164.6 1.14 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.005 175.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.7 p -146.18 156.77 43.64 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 176.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 t -66.0 -13.34 59.69 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.212 0.529 . . . . 0.0 111.12 -173.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -78.49 -3.4 43.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.733 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.4 p -134.77 -38.92 0.8 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.235 176.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.1 p -83.39 130.55 35.05 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 177.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -95.98 0.58 51.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.25 0.548 . . . . 0.0 110.989 -176.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -75.31 104.22 5.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.374 171.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.92 5.85 20.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.772 -175.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -70.45 -40.18 73.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.913 0.387 . . . . 0.0 110.378 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 72.5 m -86.96 113.62 22.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.593 176.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -105.42 144.58 32.0 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 173.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.66 ' HB3' ' HG ' ' A' ' 80' ' ' LEU . 44.1 m-80 -142.13 158.21 44.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.16 -175.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.43 -22.14 55.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.367 0.603 . . . . 0.0 109.399 171.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.66 ' HG ' ' HB3' ' A' ' 78' ' ' ASN . 2.6 pp -82.42 126.24 31.98 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.259 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -143.55 118.01 9.7 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.961 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.27 -8.18 68.8 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.844 -176.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.417 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 89.8 m-85 -126.28 162.19 26.04 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.539 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 16.1 m170 -125.92 148.54 63.04 Favored Pre-proline 0 CA--C 1.514 -0.416 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.31 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . 0.419 ' O ' ' HE1' ' A' ' 60' ' ' TYR . 42.2 Cg_endo -69.81 144.27 53.24 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.226 1.951 . . . . 0.0 111.593 175.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.463 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 59.9 tttp -146.75 134.15 20.75 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.25 -178.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -71.74 131.54 43.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 178.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.1 m -129.13 152.15 36.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.131 177.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -99.15 112.1 30.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.366 0.603 . . . . 0.0 109.55 173.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -110.19 96.82 6.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.819 -178.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.36 -99.87 0.68 Allowed Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.527 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -118.63 3.41 11.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.665 0.269 . . . . 0.0 111.405 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.4 t -124.35 150.69 45.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.784 0.326 . . . . 0.0 110.826 -176.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.485 ' HB ' ' CB ' ' A' ' 53' ' ' SER . 66.5 mt -94.33 139.13 19.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 176.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -135.57 178.39 7.08 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -175.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.56 HD12 ' O ' ' A' ' 56' ' ' LYS . 65.6 mt -121.16 101.34 10.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.616 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -95.97 -170.46 2.13 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.672 176.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.426 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 43.7 m-85 -133.65 141.89 47.81 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.281 0.562 . . . . 0.0 111.71 -175.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.463 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 46.0 p90 -122.26 151.39 41.13 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.213 172.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.417 ' HG2' ' CE1' ' A' ' 83' ' ' TYR . 41.5 mt-10 -65.77 127.76 33.27 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.193 -177.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.481 ' SG ' HG11 ' A' ' 103' ' ' VAL . 49.8 t -48.34 123.31 10.76 Favored Pre-proline 0 N--CA 1.463 0.219 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.482 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -67.83 5.57 1.02 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 123.266 2.644 . . . . 0.0 113.886 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.481 HG11 ' SG ' ' A' ' 101' ' ' CYS . 5.9 p -86.33 -19.54 8.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 O-C-N 122.1 -0.375 . . . . 0.0 110.464 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt . . . . . 0 C--N 1.334 -0.097 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.298 -176.585 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.55 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 6.3 p-10 . . . . . 0 C--O 1.226 -0.133 0 CA-C-O 120.467 0.175 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -53.61 -58.62 6.52 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.702 175.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -30.8 65.8 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.768 -178.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.55 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 52.9 mtmt -64.08 -45.55 88.21 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.066 -0.254 . . . . 0.0 110.672 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -71.87 -37.54 70.17 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 178.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.4 tp -63.19 -49.92 72.36 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.946 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -65.95 -35.81 81.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.524 177.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -62.52 -59.11 5.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.161 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.422 ' HE3' HD21 ' A' ' 54' ' ' LEU . 22.7 ptm -61.63 -40.49 95.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.938 -177.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.462 ' HZ3' ' CG2' ' A' ' 50' ' ' ILE . 55.3 tptt -62.0 -43.19 99.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.959 0.409 . . . . 0.0 109.978 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.409 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 3.2 tp10 -60.53 -46.54 89.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.579 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -64.5 -41.81 96.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.171 -176.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 71.5 t -70.98 -44.51 75.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.082 -175.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.463 ' C ' ' HD3' ' A' ' 30' ' ' LYS . 90.6 mmm -71.07 -15.24 62.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.865 0.364 . . . . 0.0 110.805 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.463 ' HD3' ' C ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -110.48 13.65 22.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.716 -178.761 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.566 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 26.5 t70 -85.41 131.74 34.34 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 170.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -61.31 -38.14 85.77 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.419 0.449 . . . . 0.0 111.845 -174.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -71.38 -47.22 57.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.168 0.509 . . . . 0.0 109.669 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.6 t -55.06 -55.13 17.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.496 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.588 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 5.0 pt20 -65.78 -27.73 68.5 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.461 ' HA ' ' HZ2' ' A' ' 39' ' ' LYS . . . -62.79 -45.66 91.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.309 0.576 . . . . 0.0 109.739 173.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -66.81 -40.78 88.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.711 176.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.68 HD13 HD13 ' A' ' 50' ' ' ILE . 1.6 mm? -58.99 -48.88 79.97 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.949 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.588 ' HG2' ' O ' ' A' ' 35' ' ' GLN . 17.9 pttm -73.55 -24.0 60.06 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.015 -178.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.43 -41.26 76.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.118 0.485 . . . . 0.0 110.229 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -115.41 28.99 8.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.526 -174.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -69.2 -14.9 63.24 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.149 0.5 . . . . 0.0 110.62 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.54 -31.22 71.17 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.677 0.751 . . . . 0.0 109.625 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.1 t -106.05 -41.77 6.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.512 -172.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.9 mt -87.32 141.71 13.97 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.761 -171.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -124.26 178.07 5.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.361 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.453 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 77.3 mt-30 -58.88 -46.05 88.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.635 0.255 . . . . 0.0 111.156 -178.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 27.2 mmtm -68.54 -35.41 77.41 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -174.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 51.9 ttm -59.51 -32.06 69.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 171.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.68 HD13 HD13 ' A' ' 38' ' ' LEU . 42.3 mm -72.18 -46.59 57.56 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.594 177.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 1.7 mp0 -58.13 -46.02 86.35 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 120.97 0.414 . . . . 0.0 111.016 175.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 50.3 tptt -58.82 -40.28 83.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.821 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -104.22 17.83 23.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.981 -175.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.422 HD21 ' HE3' ' A' ' 24' ' ' MET . 0.7 OUTLIER -60.02 -43.38 95.31 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.138 0.494 . . . . 0.0 110.114 -177.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -57.58 -40.1 78.23 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.182 176.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.565 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 6.9 mmpt? -71.46 -48.19 50.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.633 0.254 . . . . 0.0 111.272 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.47 HD22 HG21 ' A' ' 94' ' ' ILE . 95.1 mt -61.26 -39.71 91.36 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.103 0.478 . . . . 0.0 110.593 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -68.07 -40.12 82.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.243 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.73 -37.04 77.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.24 176.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -66.35 -43.68 85.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.907 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 pt -75.2 -29.92 22.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 120.713 -0.395 . . . . 0.0 112.037 -174.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -80.93 -27.05 36.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.699 0.285 . . . . 0.0 111.329 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -80.44 -176.96 5.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.928 0.394 . . . . 0.0 110.693 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.1 m -79.09 124.14 28.01 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.165 -176.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -77.67 -27.1 50.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.345 0.593 . . . . 0.0 109.99 171.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -97.97 -167.04 1.46 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.437 178.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -153.53 155.19 35.74 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.3 m -72.04 -20.08 61.74 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.301 -171.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -63.19 -21.09 65.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.167 177.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 16.3 p -115.45 -54.48 2.53 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.515 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -91.65 -179.16 5.27 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.016 -175.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.492 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 0.8 OUTLIER -93.76 24.67 3.99 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.607 -177.59 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -60.56 108.78 0.88 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.333 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -69.6 -15.28 63.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.128 0.489 . . . . 0.0 110.163 178.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -73.54 68.14 1.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.293 0.568 . . . . 0.0 109.865 174.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 40.8 m -85.13 17.32 3.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.802 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -92.1 12.84 20.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.229 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.65 ' HB2' ' HG2' ' A' ' 81' ' ' GLU . 77.0 m-20 -62.23 110.49 1.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 172.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.444 ' HG ' HD21 ' A' ' 80' ' ' LEU . 2.2 pt? -56.19 -50.99 69.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.123 -178.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.444 HD21 ' HG ' ' A' ' 79' ' ' LEU . 3.9 mm? -88.02 62.15 6.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.509 0.195 . . . . 0.0 111.0 173.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.65 ' HG2' ' HB2' ' A' ' 78' ' ' ASN . 1.6 mm-40 -72.8 159.75 33.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.959 0.409 . . . . 0.0 110.113 177.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 79.95 -8.66 49.68 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.038 -174.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.415 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 35.0 m-85 -122.17 172.57 8.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.0 m170 -129.76 144.41 52.89 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 171.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.06 135.5 19.05 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.428 2.085 . . . . 0.0 112.328 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -136.6 133.58 36.48 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 93.8 mt -71.44 138.38 49.01 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.183 -176.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.489 HG23 ' HG3' ' A' ' 97' ' ' GLU . 30.7 m -134.33 149.92 30.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.821 177.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.6 p -103.58 117.91 49.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-O 121.089 0.471 . . . . 0.0 109.983 174.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -117.97 93.92 4.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.765 -177.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 58.62 -87.96 0.02 OUTLIER Glycine 0 CA--C 1.521 0.409 0 CA-C-N 115.463 -0.79 . . . . 0.0 114.461 175.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.716 ' HD3' ' H ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -99.07 -15.19 19.11 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -170.292 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.6 p -148.6 170.73 17.46 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.224 0.535 . . . . 0.0 111.569 -173.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.47 HG21 HD22 ' A' ' 57' ' ' LEU . 59.4 mt -106.78 136.49 41.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.377 -179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -130.06 179.2 6.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.899 0.38 . . . . 0.0 110.732 -173.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 57.9 mt -127.22 114.11 35.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.259 -178.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.489 ' HG3' HG23 ' A' ' 88' ' ' VAL . 31.6 mt-10 -114.39 153.19 30.29 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.415 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 38.2 m-85 -105.68 130.39 53.71 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.123 0.487 . . . . 0.0 111.923 -173.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.3 p90 -106.67 149.66 27.03 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 171.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -69.75 139.79 53.35 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.214 -0.594 . . . . 0.0 110.701 -174.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.567 ' SG ' HG11 ' A' ' 103' ' ' VAL . 49.2 t -48.07 123.69 10.38 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.241 177.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.96 -14.02 40.82 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.306 2.671 . . . . 0.0 113.887 -172.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.567 HG11 ' SG ' ' A' ' 101' ' ' CYS . 8.4 p -67.81 -25.17 31.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.977 0.418 . . . . 0.0 110.408 178.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.679 -179.819 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 . . . . . 0 N--CA 1.461 0.095 0 CA-C-O 121.024 0.44 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.515 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 81.3 t80 -63.52 -51.79 63.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.839 175.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.4 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -71.17 -31.84 68.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -177.514 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -64.14 -48.86 74.38 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.702 177.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 17' ' ' PHE . 6.1 ptp180 -64.89 -31.41 72.63 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.8 tp -68.67 -49.37 59.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.254 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.5 -35.81 81.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.937 0.399 . . . . 0.0 110.03 176.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -60.98 -55.48 32.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.265 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.542 ' HE3' ' HG ' ' A' ' 54' ' ' LEU . 24.8 ptm -65.27 -38.34 89.99 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.153 -179.182 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.5 tptm -63.56 -41.71 98.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.155 0.503 . . . . 0.0 110.013 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.466 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 15.2 tm-20 -58.34 -47.11 84.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.954 177.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -58.63 -55.23 37.77 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.706 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.419 HG21 ' O ' ' A' ' 24' ' ' MET . 96.3 t -62.65 -42.21 95.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.949 0.404 . . . . 0.0 111.167 -174.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.5 mmt -77.51 -5.62 50.67 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -174.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HE3' ' O ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -127.24 6.51 6.43 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.306 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.576 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 0.8 OUTLIER -84.23 136.91 33.76 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.343 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -60.09 -49.18 78.67 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.325 -169.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -65.24 -35.79 82.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.153 0.502 . . . . 0.0 110.669 -174.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 99.5 t -62.21 -37.82 79.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.095 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 70.8 mm-40 -58.73 -44.69 90.54 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.321 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.99 -48.17 82.53 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.107 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -62.23 -41.83 98.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.514 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' A' ' 38' ' ' LEU . 2.7 mm? -59.8 -42.21 92.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.802 -178.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -82.42 -21.79 35.58 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.881 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -62.3 -50.89 69.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.556 0.693 . . . . 0.0 110.067 175.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -112.83 36.03 3.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.586 -177.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 43' ' ' GLU . 7.3 pt-20 -52.15 -40.54 61.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.464 -175.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.438 ' N ' ' HG3' ' A' ' 42' ' ' GLU . 15.2 tp10 -85.49 -13.17 49.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.078 0.466 . . . . 0.0 111.058 -173.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.3 t -99.07 -38.25 6.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.112 0.482 . . . . 0.0 110.754 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.8 mt -83.13 150.18 4.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.648 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -124.23 165.52 17.48 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 173.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -60.43 -40.06 89.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.073 0.463 . . . . 0.0 111.502 -175.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.464 ' HD3' ' HA ' ' A' ' 48' ' ' LYS . 68.1 mmtt -73.03 -31.85 64.71 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.579 -178.199 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.537 ' HE3' ' HA ' ' A' ' 92' ' ' ARG . 54.4 ttm -54.41 -43.77 71.78 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.897 0.379 . . . . 0.0 110.193 171.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.11 -44.19 94.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.751 178.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.501 ' HA ' ' HB2' ' A' ' 54' ' ' LEU . 41.2 mt-10 -70.97 -38.45 72.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.759 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -66.57 -23.98 66.28 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.034 0.445 . . . . 0.0 111.372 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.4 m -120.54 25.68 9.62 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.25 176.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.542 ' HG ' ' HE3' ' A' ' 24' ' ' MET . 51.4 tp -61.58 -34.28 75.32 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.423 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -67.34 -33.49 75.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.031 176.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.429 ' HD3' ' HA ' ' A' ' 56' ' ' LYS . 54.4 mmtt -74.6 -43.77 53.95 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.511 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.84 -37.9 80.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.954 0.407 . . . . 0.0 109.989 175.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -74.98 -39.21 61.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.337 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.449 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 40.8 tt0 -63.25 -32.06 73.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.304 0.573 . . . . 0.0 109.858 176.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.486 ' HE1' ' C ' ' A' ' 85' ' ' PRO . 69.0 t80 -63.76 -54.88 28.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.408 178.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 21.5 pt -65.51 -28.91 45.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.936 -174.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.449 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 9.4 pt-20 -78.23 -37.03 46.25 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.044 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -86.33 113.49 22.36 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.693 0.282 . . . . 0.0 111.67 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.462 ' HB2' ' HD3' ' A' ' 85' ' ' PRO . 11.5 m 53.55 62.13 2.79 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.597 173.22 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -63.49 -27.13 69.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 122.177 0.989 . . . . 0.0 108.777 173.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.3 p30 -138.52 -157.28 0.76 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.272 -1.331 . . . . 0.0 108.188 173.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.6 p -151.25 153.41 34.82 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 170.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 t -65.1 -29.87 70.77 Favored 'General case' 0 C--N 1.313 -1.014 0 O-C-N 123.782 0.677 . . . . 0.0 110.373 -170.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -55.79 -36.12 67.05 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.978 178.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.2 p -103.72 -6.71 21.26 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.57 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -105.27 168.44 9.07 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -95.05 -13.01 25.56 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -76.0 114.73 14.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.343 178.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -87.41 -22.55 24.94 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 175.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -75.84 75.76 2.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.897 178.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 38.4 t -163.55 133.91 4.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.766 178.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -116.29 77.78 1.13 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.029 0.442 . . . . 0.0 111.036 -175.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -72.25 136.58 46.37 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.358 172.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 46.9 tp -62.84 -67.45 0.42 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.467 ' HB3' ' CD2' ' A' ' 83' ' ' TYR . 6.0 mp -88.08 90.71 8.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.742 170.051 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -83.0 144.84 29.68 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.86 -7.8 78.82 Favored Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -169.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.467 ' CD2' ' HB3' ' A' ' 80' ' ' LEU . 46.1 m-85 -126.07 164.05 21.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.578 -0.311 . . . . 0.0 110.334 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -128.51 154.23 79.4 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 169.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . 0.542 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 71.8 Cg_endo -80.14 165.79 21.2 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.467 2.111 . . . . 0.0 112.167 177.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -152.69 147.22 25.85 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 173.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -78.52 140.6 38.54 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.447 177.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.9 m -137.81 141.05 39.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.579 173.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.5 p -89.17 129.69 39.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.171 0.51 . . . . 0.0 111.168 -178.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -132.3 96.08 3.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.736 175.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.52 -113.8 4.6 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.753 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.537 ' HA ' ' HE3' ' A' ' 49' ' ' MET . 29.4 mmt180 -111.61 14.09 21.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.113 0.483 . . . . 0.0 110.321 177.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 48.3 t -123.98 148.05 47.27 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.276 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 89.4 mt -110.63 125.94 67.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.032 178.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -109.68 174.78 5.71 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.881 -175.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.425 HD11 ' O ' ' A' ' 56' ' ' LYS . 58.0 mt -126.38 105.74 14.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.625 -176.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.542 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 17.4 mm-40 -95.93 -173.88 2.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.877 178.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -135.61 143.77 45.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.037 0.446 . . . . 0.0 111.098 179.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -129.71 155.95 45.07 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 173.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -71.79 137.47 47.66 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.831 0.348 . . . . 0.0 110.598 -178.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.565 ' SG ' HG11 ' A' ' 103' ' ' VAL . 43.9 t -55.82 122.83 48.96 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.108 178.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -71.02 -7.77 22.15 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.956 2.437 . . . . 0.0 113.536 -175.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.565 HG11 ' SG ' ' A' ' 101' ' ' CYS . 3.8 p -69.67 -19.67 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.009 0.433 . . . . 0.0 110.429 178.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.003 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.602 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 0.5 OUTLIER . . . . . 0 CA--C 1.518 -0.282 0 CA-C-O 120.444 0.164 . . . . 0.0 110.951 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -59.14 -50.0 75.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.83 0.348 . . . . 0.0 110.063 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -29.25 65.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.161 -179.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.407 ' HE3' ' HB3' ' A' ' 19' ' ' LYS . 24.3 mtpp -63.24 -49.07 75.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.405 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.602 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 20.5 mtm105 -69.03 -40.76 78.44 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 121.456 0.646 . . . . 0.0 109.449 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 34.1 tp -54.54 -49.29 70.64 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.491 -1.231 . . . . 0.0 111.212 177.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -75.45 -28.32 59.25 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.638 177.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.409 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 8.6 tp-100 -62.0 -52.64 63.18 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.764 ' HE2' ' HG ' ' A' ' 54' ' ' LEU . 25.2 ptm -66.3 -36.43 82.94 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.407 177.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.427 ' HG3' ' HE3' ' A' ' 29' ' ' MET . 4.7 tppp? -55.3 -50.0 70.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.942 0.401 . . . . 0.0 110.487 175.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -58.04 -47.04 84.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.503 178.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.43 ' HB3' ' HE3' ' A' ' 27' ' ' LYS . 25.9 mtpp -59.8 -42.67 93.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.811 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.612 HG13 HG11 ' A' ' 34' ' ' VAL . 84.5 t -67.81 -36.48 75.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.076 -176.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.427 ' HE3' ' HG3' ' A' ' 25' ' ' LYS . 23.4 ptp -82.65 -0.92 49.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.179 0.514 . . . . 0.0 110.387 178.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.5 tptt -91.61 -12.17 35.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.294 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.446 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 24.9 t70 -85.48 136.97 33.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.193 -176.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.96 -47.03 75.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.652 -177.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -63.52 -45.37 90.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.036 0.446 . . . . 0.0 110.444 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . 0.612 HG11 HG13 ' A' ' 28' ' ' VAL . 49.7 t -56.41 -56.4 13.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.824 -179.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.514 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.2 pt20 -66.13 -29.95 70.35 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -176.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.62 -40.75 97.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.016 0.436 . . . . 0.0 109.932 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.474 ' CE2' HD12 ' A' ' 45' ' ' ILE . 93.1 t80 -70.23 -36.34 74.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.95 177.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.431 HD11 ' HA ' ' A' ' 38' ' ' LEU . 1.4 mm? -56.84 -49.46 75.37 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.412 178.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 35' ' ' GLN . 5.2 ptpp? -77.7 -21.33 52.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.237 0.542 . . . . 0.0 110.624 -178.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.81 -60.72 2.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.327 174.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -102.48 33.85 3.0 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.737 -174.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -61.62 -20.64 63.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.417 178.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -85.89 -16.06 39.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.807 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 41.3 t -109.94 -42.46 5.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.854 0.359 . . . . 0.0 111.591 -173.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.474 HD12 ' CE2' ' A' ' 37' ' ' PHE . 56.3 mt -78.43 144.0 11.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.668 -175.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -106.73 165.39 11.34 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.739 175.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -58.04 -45.15 87.45 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.925 0.393 . . . . 0.0 111.023 176.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.577 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 14.1 mmmm -67.01 -37.35 84.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.708 0.766 . . . . 0.0 110.323 -178.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.437 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 19.1 ttt -57.2 -37.61 72.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.296 176.091 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 28.3 mm -63.73 -54.61 29.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.404 178.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.577 ' OE2' ' HE2' ' A' ' 48' ' ' LYS . 2.0 pp20? -63.1 -43.88 97.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.086 0.469 . . . . 0.0 111.414 -178.155 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.569 ' HE2' ' HA ' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -57.3 -31.91 66.12 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.839 178.124 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 73.3 p -108.92 14.26 24.26 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.457 -178.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.764 ' HG ' ' HE2' ' A' ' 24' ' ' MET . 51.8 tp -59.05 -34.45 71.95 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.928 0.394 . . . . 0.0 110.645 -179.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -66.91 -38.25 85.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.754 176.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.47 ' O ' HD13 ' A' ' 96' ' ' ILE . 27.8 mmmt -66.04 -47.97 72.6 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.058 0.456 . . . . 0.0 109.944 176.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.773 ' HG ' HD21 ' A' ' 87' ' ' LEU . 11.0 mp -64.64 -35.88 82.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.308 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -69.34 -43.05 74.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.73 0.3 . . . . 0.0 110.247 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.493 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 9.2 tp10 -58.66 -37.19 75.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.815 0.817 . . . . 0.0 109.801 174.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.479 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 87.9 t80 -61.83 -47.85 83.2 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.581 -1.19 . . . . 0.0 111.689 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.538 HD12 ' HA ' ' A' ' 28' ' ' VAL . 29.8 pt -76.36 -30.54 19.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -177.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.493 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 10.1 pt-20 -79.85 -20.09 46.82 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.466 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 10.1 pt20 -82.29 175.8 9.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.862 0.363 . . . . 0.0 110.206 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.1 m -68.35 102.88 1.49 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.102 0.477 . . . . 0.0 110.963 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -69.62 -31.15 69.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.282 177.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -93.76 -165.77 1.38 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.049 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -157.58 162.66 38.77 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.042 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.496 ' HA ' ' O ' ' A' ' 71' ' ' SER . 8.0 p -69.32 -18.93 63.87 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 123.48 0.487 . . . . 0.0 111.908 -174.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -77.83 4.98 10.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.109 0.48 . . . . 0.0 110.946 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 26.1 p -145.51 -44.51 0.21 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.712 175.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.496 ' O ' ' HA ' ' A' ' 68' ' ' SER . 2.5 m -105.32 125.37 50.91 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.215 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -87.44 11.02 15.66 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.011 0.434 . . . . 0.0 111.232 -177.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.65 115.16 3.42 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.924 177.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -86.52 -5.3 59.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.679 176.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -60.95 -47.58 85.8 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.9 -177.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 19.0 p -101.28 143.73 30.99 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.8 -176.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -94.95 104.55 16.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.06 0.457 . . . . 0.0 110.238 176.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.33 103.34 11.03 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 174.209 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.6 tp -52.53 -61.95 1.95 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.727 -177.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.587 ' HB3' ' HB2' ' A' ' 83' ' ' TYR . 4.5 mm? -84.89 87.38 7.34 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.28 128.52 36.52 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.561 0.696 . . . . 0.0 110.785 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.25 -9.66 65.2 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.354 -175.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.587 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . 37.0 m-85 -117.39 168.39 10.4 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 122.473 0.309 . . . . 0.0 110.517 178.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.412 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 12.2 m170 -131.83 148.22 69.05 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.543 172.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -76.63 136.73 17.49 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.211 1.94 . . . . 0.0 111.577 176.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.458 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 40.3 ttpt -136.86 135.72 38.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.08 0.467 . . . . 0.0 110.191 177.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.773 HD21 ' HG ' ' A' ' 57' ' ' LEU . 1.0 OUTLIER -67.65 130.42 42.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.369 177.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.5 m -130.51 148.62 33.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 120.939 0.4 . . . . 0.0 110.88 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.7 p -97.64 115.08 36.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 173.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -117.89 96.17 5.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.447 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 63.56 -100.61 0.38 Allowed Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.481 -0.782 . . . . 0.0 112.827 177.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -112.18 15.16 20.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.144 0.497 . . . . 0.0 111.758 -176.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.1 p -143.85 149.02 36.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.681 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 62.6 mt -98.78 132.66 43.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 174.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -132.9 178.3 6.98 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.051 0.453 . . . . 0.0 110.699 -171.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.47 HD13 ' O ' ' A' ' 56' ' ' LYS . 40.7 mt -119.62 113.96 42.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.329 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -105.23 178.52 4.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.163 176.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.516 ' CE1' ' HB2' ' A' ' 80' ' ' LEU . 16.3 m-85 -127.59 129.16 46.8 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.636 179.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.458 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 54.0 p90 -113.17 150.78 31.76 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 174.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -65.21 129.96 41.61 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.403 -178.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 36.1 t -45.19 122.5 5.11 Favored Pre-proline 0 N--CA 1.463 0.21 0 O-C-N 123.409 0.443 . . . . 0.0 109.81 173.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.47 -30.09 86.95 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.856 2.371 . . . . 0.0 111.867 -177.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 16.9 t -66.63 -25.35 34.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.355 -178.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt . . . . . 0 N--CA 1.462 0.16 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.465 -174.265 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.74 0.305 . . . . 0.0 110.526 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -64.46 -48.26 75.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.67 178.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -32.8 70.14 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 -178.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HE3' ' HB3' ' A' ' 19' ' ' LYS . 9.1 mmmt -57.74 -55.69 31.65 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.771 177.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.413 ' HA ' ' HB2' ' A' ' 23' ' ' GLN . 7.4 ptm85 -69.36 -25.73 64.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.381 -176.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.7 tp -68.74 -50.7 48.5 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.964 0.411 . . . . 0.0 111.0 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -73.05 -30.75 63.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.462 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.413 ' HB2' ' HA ' ' A' ' 20' ' ' ARG . 8.2 mt-30 -60.24 -57.0 14.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.768 178.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.434 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.6 ptm -57.51 -43.11 83.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.095 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.8 tptp -63.07 -39.58 95.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.748 0.309 . . . . 0.0 110.808 177.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -61.61 -50.72 71.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.582 178.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -56.27 -48.57 76.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.012 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 24' ' ' MET . 89.1 t -60.43 -43.0 93.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.101 0.477 . . . . 0.0 110.569 -179.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.6 mtp -86.26 13.92 7.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.143 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -110.66 -34.04 6.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.98 0.419 . . . . 0.0 110.555 177.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.68 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 25.2 t70 -59.58 127.22 30.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.282 -174.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -69.59 -25.4 63.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.44 -174.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -83.04 -35.96 25.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.409 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.2 t -57.43 -47.13 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.875 0.369 . . . . 0.0 110.46 171.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.68 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 47.8 mt-30 -65.24 -36.65 84.81 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.319 0.581 . . . . 0.0 110.434 179.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.55 -39.99 93.09 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.333 175.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.529 ' CD2' HD23 ' A' ' 87' ' ' LEU . 58.0 t80 -66.07 -40.66 91.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.792 176.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 38' ' ' LEU . 2.1 mm? -59.79 -42.01 92.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.291 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -80.63 -24.11 39.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.118 0.485 . . . . 0.0 110.655 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.04 -53.24 52.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.556 0.693 . . . . 0.0 110.124 178.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -113.94 31.93 6.21 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.462 -173.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 9.8 pt-20 -62.91 -18.86 63.61 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.573 -178.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -77.71 -27.92 50.78 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.491 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 37.9 t -103.75 -37.18 4.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.55 -173.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.465 HD11 ' CZ ' ' A' ' 37' ' ' PHE . 74.0 mt -80.03 148.43 5.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.681 -174.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -130.06 174.5 9.73 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 174.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -59.24 -44.55 92.35 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 -175.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -67.17 -36.52 81.95 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.965 0.412 . . . . 0.0 111.149 -175.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 46.7 ttm -58.18 -38.0 75.83 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.842 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.2 mm -68.18 -48.48 73.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.622 176.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -53.47 -48.77 68.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.161 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.618 ' N ' ' HE2' ' A' ' 52' ' ' LYS . 0.8 OUTLIER -65.76 -43.25 89.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 -178.353 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.416 ' O ' HD12 ' A' ' 57' ' ' LEU . 8.3 m -89.95 13.02 15.75 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.189 -173.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.92 -33.9 69.27 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.028 0.442 . . . . 0.0 110.668 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -70.29 -37.44 74.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.585 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.446 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.6 mmmt -69.16 -42.62 75.66 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 120.911 0.386 . . . . 0.0 110.398 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.872 ' HG ' HD22 ' A' ' 87' ' ' LEU . 9.6 mp -61.78 -40.72 96.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.996 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -69.21 -44.37 72.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.104 0.478 . . . . 0.0 110.238 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -54.23 -45.85 72.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.778 174.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.435 ' CG ' HD11 ' A' ' 87' ' ' LEU . 32.9 t80 -60.25 -50.81 72.19 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.846 -1.07 . . . . 0.0 112.768 -178.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.467 ' O ' ' HE2' ' A' ' 65' ' ' LYS . 29.8 pt -64.82 -30.28 49.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -173.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.415 ' HG2' HG13 ' A' ' 61' ' ' ILE . 6.7 mm-40 -90.01 -29.69 18.26 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.27 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.421 HE21 ' HA ' ' A' ' 60' ' ' TYR . 22.5 pt20 -85.87 133.13 33.98 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.686 -176.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.474 ' HB3' ' HG3' ' A' ' 85' ' ' PRO . 15.2 t 49.7 40.12 19.22 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.287 0.565 . . . . 0.0 112.254 168.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.467 ' HE2' ' O ' ' A' ' 61' ' ' ILE . 11.8 ptpt -63.85 -24.32 67.7 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.302 0.572 . . . . 0.0 110.203 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.525 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 34.1 p30 -130.82 -170.35 2.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.026 171.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.0 p -152.58 164.1 38.31 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 176.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.529 ' HB3' ' OE2' ' A' ' 81' ' ' GLU . 31.0 t -63.48 -37.01 85.65 Favored 'General case' 0 C--N 1.317 -0.805 0 O-C-N 123.294 0.371 . . . . 0.0 110.973 -170.089 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.64 ' CZ ' ' HG3' ' A' ' 104' ' ' LYS . 2.6 t80 -55.56 -21.99 19.77 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.246 0.618 . . . . 0.0 111.935 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.5 p -124.28 11.57 8.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.159 0.504 . . . . 0.0 110.204 -179.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.5 t -104.68 121.25 43.19 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.806 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -84.05 -21.9 31.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.805 178.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.03 137.82 32.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.291 174.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -83.72 -21.23 32.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.116 -176.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -100.27 27.95 5.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.052 0.453 . . . . 0.0 111.082 -172.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 31.7 t -80.65 149.94 29.62 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -102.1 112.04 24.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.862 0.363 . . . . 0.0 111.688 -176.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -176.27 149.15 0.82 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.609 173.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.5 mp -100.32 -41.72 6.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.184 0.516 . . . . 0.0 110.49 -177.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.422 ' HG ' ' CE2' ' A' ' 98' ' ' TYR . 3.1 mm? -72.45 112.01 8.14 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.381 -177.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.529 ' OE2' ' HB3' ' A' ' 68' ' ' SER . 4.9 tp10 -95.33 138.74 32.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.148 176.074 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 78.05 -7.66 42.68 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.367 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -125.6 153.75 43.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 117.237 0.519 . . . . 0.0 111.2 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.525 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 13.1 m170 -129.5 157.51 76.18 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 168.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . 0.474 ' HG3' ' HB3' ' A' ' 64' ' ' SER . 73.0 Cg_endo -80.21 148.53 19.07 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.526 2.151 . . . . 0.0 111.213 176.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.617 ' HB2' ' CD1' ' A' ' 99' ' ' TYR . 20.7 ttpp -137.8 144.11 41.38 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.081 0.467 . . . . 0.0 109.874 175.332 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.872 HD22 ' HG ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -68.69 128.68 37.53 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.744 176.137 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 15.6 m -128.02 145.57 34.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.067 179.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 10.8 p -103.69 115.86 46.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.646 0.736 . . . . 0.0 109.881 174.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -114.71 95.51 5.27 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.274 179.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.53 -115.08 6.08 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.876 -176.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -107.05 18.61 21.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.069 0.461 . . . . 0.0 111.02 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.0 m -131.05 143.2 50.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.821 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 77.1 mt -102.18 124.15 55.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -121.62 178.33 4.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -175.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.446 HD11 ' O ' ' A' ' 56' ' ' LYS . 54.2 mt -125.02 112.57 32.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.707 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -126.93 158.21 37.42 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.422 ' CE2' ' HG ' ' A' ' 80' ' ' LEU . 12.9 m-85 -97.24 158.28 15.53 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -166.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.617 ' CD1' ' HB2' ' A' ' 86' ' ' LYS . 55.3 p90 -139.6 160.92 38.76 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.356 175.302 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -72.32 129.42 38.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.082 0.468 . . . . 0.0 111.586 -179.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 44.0 t -46.88 122.02 7.13 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.607 172.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.89 -22.26 49.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.648 2.232 . . . . 0.0 112.258 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.8 t -68.06 -15.96 20.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.951 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.64 ' HG3' ' CZ ' ' A' ' 69' ' ' TYR . 28.3 tttm . . . . . 0 N--CA 1.456 -0.161 0 CA-C-O 121.167 0.508 . . . . 0.0 110.263 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.584 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 1.5 m-20 . . . . . 0 CA--C 1.52 -0.175 0 CA-C-O 120.649 0.261 . . . . 0.0 110.669 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -49.5 -57.1 7.67 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.467 -178.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 1.5 pt20 -67.59 -29.65 69.05 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.463 -175.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.697 ' HE2' ' HA ' ' A' ' 19' ' ' LYS . 9.5 mmpt? -68.04 -37.72 81.67 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.864 -0.335 . . . . 0.0 111.296 -178.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.584 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 54.3 mtt180 -70.34 -40.7 73.96 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.646 0.736 . . . . 0.0 109.051 174.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.6 tp -57.11 -49.31 76.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.232 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 11.0 mm-40 -66.14 -30.56 71.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.15 0.5 . . . . 0.0 110.536 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.473 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 22.5 tt0 -70.12 -53.21 18.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.794 -176.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.471 ' HE3' HD21 ' A' ' 54' ' ' LEU . 25.8 ptm -67.82 -36.33 80.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.633 178.595 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HG3' ' HE2' ' A' ' 29' ' ' MET . 23.9 tptm -58.13 -42.39 85.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.16 0.505 . . . . 0.0 109.841 175.546 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.437 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 3.7 tp10 -62.58 -49.31 75.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.961 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -54.51 -48.78 71.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.352 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 24' ' ' MET . 92.3 t -61.12 -45.18 99.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.128 -178.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.47 ' HE2' ' HG3' ' A' ' 25' ' ' LYS . 16.7 ptp -82.64 3.4 29.05 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.417 -176.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 13.9 mptt -106.13 -6.13 18.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.688 0.28 . . . . 0.0 110.957 177.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.682 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 15.2 t70 -85.63 129.48 34.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.676 0.274 . . . . 0.0 110.504 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -65.12 -36.74 85.22 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.466 -174.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.43 -38.95 68.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.979 -176.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.4 t -55.75 -49.97 70.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.518 174.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 57.0 mt-30 -61.67 -41.02 96.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.899 -178.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.711 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . . . -57.39 -42.1 81.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.72 176.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.487 ' CG ' ' HB3' ' A' ' 87' ' ' LEU . 54.6 t80 -69.62 -39.91 76.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.321 177.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 38' ' ' LEU . 1.7 mm? -57.3 -43.28 83.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.41 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.711 ' HE2' ' HA ' ' A' ' 36' ' ' ALA . 52.6 pttt -83.94 -17.76 39.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 111.121 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.83 -52.99 37.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.102 174.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -111.33 33.05 4.9 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.721 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.66 -33.14 63.82 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -175.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -82.09 -23.63 35.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.034 0.445 . . . . 0.0 111.128 -177.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.7 t -91.81 -41.88 13.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.193 0.521 . . . . 0.0 110.593 -175.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.408 HD11 ' CE2' ' A' ' 37' ' ' PHE . 74.1 mt -73.13 146.67 10.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.549 -178.521 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -120.72 161.29 21.68 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -60.61 -37.85 82.75 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.919 176.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.553 ' O ' ' HG2' ' A' ' 52' ' ' LYS . 13.3 mmmm -63.64 -37.54 87.71 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.172 175.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.537 ' HG2' HG13 ' A' ' 94' ' ' ILE . 46.6 ttm -64.0 -32.38 73.91 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.454 177.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.427 HD11 HD11 ' A' ' 38' ' ' LEU . 35.5 mm -62.3 -54.44 34.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.331 -179.511 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.472 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 2.0 pt-20 -60.81 -47.1 87.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.842 0.353 . . . . 0.0 111.757 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' A' ' 48' ' ' LYS . 74.4 mmtt -55.87 -48.08 76.2 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.383 0.611 . . . . 0.0 110.536 178.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.518 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.4 m -94.37 13.61 23.13 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.565 -173.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -54.44 -47.85 72.4 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.537 0.684 . . . . 0.0 110.265 178.81 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -56.22 -40.84 74.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.735 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.513 ' O ' HD13 ' A' ' 96' ' ' ILE . 13.6 mmmm -70.18 -44.04 69.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.994 -179.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 53' ' ' SER . 75.1 mt -62.74 -38.88 92.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.24 0.543 . . . . 0.0 110.187 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -69.74 -41.43 75.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.249 177.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.06 -37.78 80.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.012 0.434 . . . . 0.0 110.511 176.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.461 ' CD1' HD11 ' A' ' 87' ' ' LEU . 89.1 t80 -56.38 -50.51 71.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.105 177.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.2 pt -75.49 -29.71 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.812 -178.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -66.42 -46.75 75.46 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.517 177.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -65.81 -175.16 0.27 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.85 -0.613 . . . . 0.0 112.11 -177.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.782 ' HB3' ' HA ' ' A' ' 78' ' ' ASN . 2.9 p -59.92 102.6 0.16 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.193 179.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -68.88 -33.1 73.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.469 0.652 . . . . 0.0 110.349 -178.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -124.94 -156.2 0.71 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 173.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.665 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -148.53 152.1 36.26 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 119.659 -0.816 . . . . 0.0 109.843 174.536 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.645 ' HA ' ' O ' ' A' ' 71' ' ' SER . 0.7 OUTLIER -74.68 -23.34 58.61 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.405 -169.951 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -58.26 -20.65 43.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.153 176.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.3 p -118.27 -47.05 2.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.967 0.413 . . . . 0.0 110.862 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.645 ' O ' ' HA ' ' A' ' 68' ' ' SER . 8.6 m -100.85 118.37 36.77 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.722 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -83.44 56.57 3.63 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.755 0.788 . . . . 0.0 110.18 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -85.43 122.58 29.78 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.939 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -75.74 -15.43 60.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.037 -173.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -119.15 -2.73 10.68 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -174.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 44.7 t -73.18 114.11 11.0 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.893 0.378 . . . . 0.0 110.433 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -77.31 115.59 17.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.886 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.782 ' HA ' ' HB3' ' A' ' 64' ' ' SER . 10.6 m-80 -111.34 132.46 54.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.401 -176.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.415 HD21 ' N ' ' A' ' 79' ' ' LEU . 3.1 mm? -89.6 -79.25 0.34 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.811 -0.632 . . . . 0.0 109.331 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.446 ' HB3' ' HD2' ' A' ' 83' ' ' TYR . 7.2 mp -87.35 88.39 7.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.062 175.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -64.27 144.4 57.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.66 -179.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.21 -8.1 72.46 Favored Glycine 0 N--CA 1.445 -0.752 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.201 -177.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.446 ' HD2' ' HB3' ' A' ' 80' ' ' LEU . 61.2 m-85 -121.58 167.34 13.0 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 178.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -131.85 145.69 58.58 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 172.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -79.67 135.29 11.46 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.414 2.076 . . . . 0.0 111.709 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.639 ' HB2' ' HZ3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -125.66 139.68 53.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.309 0.576 . . . . 0.0 109.784 173.662 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.487 ' HB3' ' CG ' ' A' ' 37' ' ' PHE . 1.1 tp -77.39 131.52 38.08 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.054 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.437 ' CG2' ' HB3' ' A' ' 95' ' ' ASP . 30.0 m -136.31 170.0 19.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.3 p -112.92 114.52 47.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.368 0.604 . . . . 0.0 110.27 175.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -121.14 107.96 13.22 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.644 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.26 -112.47 3.65 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.396 -178.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.419 ' HA ' ' HD3' ' A' ' 92' ' ' ARG . 30.7 mmt180 -117.92 12.01 13.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.167 0.508 . . . . 0.0 109.932 177.474 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 38.1 p -128.36 150.79 49.94 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.078 -177.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.537 HG13 ' HG2' ' A' ' 49' ' ' MET . 77.9 mt -86.38 131.91 33.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 176.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.437 ' HB3' ' CG2' ' A' ' 88' ' ' VAL . 13.6 t0 -119.5 169.26 10.2 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.932 -170.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.513 HD13 ' O ' ' A' ' 56' ' ' LYS . 60.5 mt -126.86 113.93 35.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.908 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -118.14 159.93 22.43 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 175.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -108.84 129.0 55.39 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.176 0.513 . . . . 0.0 111.527 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 45.8 p90 -108.69 153.84 22.87 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -73.41 135.54 44.21 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.541 -176.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.55 ' SG ' HG12 ' A' ' 103' ' ' VAL . 47.7 t -45.3 126.3 5.86 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.802 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.51 -13.65 22.05 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.364 2.709 . . . . 0.0 113.885 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.55 HG12 ' SG ' ' A' ' 101' ' ' CYS . 9.9 p -66.9 -23.08 30.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 121.041 0.448 . . . . 0.0 110.348 178.213 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 9.0 mmmm . . . . . 0 C--N 1.332 -0.178 0 CA-C-O 121.578 0.704 . . . . 0.0 109.85 174.503 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.68 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 0.5 OUTLIER . . . . . 0 C--O 1.227 -0.083 0 CA-C-O 120.428 0.156 . . . . 0.0 110.635 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -55.96 -50.95 69.38 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.332 175.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -30.67 69.08 Favored 'General case' 0 C--O 1.226 -0.179 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -178.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 29.5 mmmt -60.33 -47.74 84.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.354 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.68 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 14.0 mtm-85 -71.06 -53.31 15.15 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.1 -51.11 70.61 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.506 -174.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -75.98 -28.28 57.78 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 -176.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 8.9 tt0 -64.45 -55.84 18.2 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.079 176.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.56 ' O ' HG23 ' A' ' 28' ' ' VAL . 27.6 ptm -62.0 -40.78 96.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.72 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HA ' HD23 ' A' ' 54' ' ' LEU . 80.8 tttt -62.8 -42.58 99.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.43 -178.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.476 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 14.3 tt0 -62.68 -45.97 90.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.864 0.364 . . . . 0.0 110.106 177.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.0 mtpt -55.46 -45.21 76.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.456 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 24' ' ' MET . 72.1 t -61.77 -42.42 94.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.678 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.419 ' HE2' ' HG2' ' A' ' 25' ' ' LYS . 21.8 ptp -84.77 14.61 4.57 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.29 -177.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 2.4 mptm? -115.25 -14.83 11.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.059 176.092 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.628 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 19.6 t70 -74.16 135.33 42.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.069 0.461 . . . . 0.0 110.662 -177.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -66.72 -36.67 83.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.965 -175.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -75.3 -35.86 61.22 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.017 0.437 . . . . 0.0 110.065 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.1 t -59.66 -41.01 83.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.487 174.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.628 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 74.1 mm-40 -57.15 -49.03 77.2 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.139 0.495 . . . . 0.0 110.04 176.225 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.452 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -56.14 -40.54 73.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.476 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.32 -43.54 85.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.809 0.337 . . . . 0.0 110.981 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.525 HD11 HD13 ' A' ' 50' ' ' ILE . 3.5 mm? -63.02 -43.25 99.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.824 -177.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -70.77 -32.62 69.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.188 0.518 . . . . 0.0 110.721 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -74.36 -29.57 61.62 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.333 -177.727 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -118.27 28.54 8.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.184 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -63.34 -16.95 61.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.608 0.718 . . . . 0.0 109.931 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -73.89 -25.84 60.23 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.908 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.9 t -119.96 -33.73 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -170.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.515 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 73.1 mt -71.8 143.83 13.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.358 0.599 . . . . 0.0 112.203 -172.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -120.1 166.65 13.12 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.91 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -62.52 -41.64 98.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.333 0.587 . . . . 0.0 109.588 174.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -63.89 -37.64 88.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.618 -179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.572 ' HE3' ' HA ' ' A' ' 92' ' ' ARG . 54.0 ttm -58.56 -39.44 80.27 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.551 176.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.525 HD13 HD11 ' A' ' 38' ' ' LEU . 46.6 mm -67.29 -48.31 78.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.742 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -61.78 -37.77 85.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.288 -178.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.471 ' C ' ' HD3' ' A' ' 52' ' ' LYS . 1.1 tmtp? -71.7 -45.99 60.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.386 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 m -92.46 16.55 11.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.452 -173.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -56.52 -40.07 74.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.255 0.55 . . . . 0.0 110.383 178.934 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -62.1 -45.67 92.44 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.462 177.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.457 ' O ' HD12 ' A' ' 96' ' ' ILE . 31.6 mmmt -64.88 -49.57 69.99 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.891 0.377 . . . . 0.0 110.752 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.41 ' CD2' ' HG ' ' A' ' 87' ' ' LEU . 90.0 mt -60.76 -39.12 87.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.886 -178.239 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -69.9 -43.08 72.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.696 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -61.2 -31.74 71.5 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.336 0.589 . . . . 0.0 109.839 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.475 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 34.4 t80 -66.4 -46.23 77.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.189 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.2 pt -75.5 -29.01 20.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -176.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -74.23 -35.62 63.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.533 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 10.1 pt20 -75.4 -175.76 2.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.027 0.441 . . . . 0.0 111.016 -178.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.0 t -71.35 93.71 1.16 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.299 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -73.83 -26.98 60.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.29 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -96.09 -172.75 2.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.441 177.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.582 ' HA ' ' ND2' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -141.56 154.21 45.31 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.602 179.573 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.494 ' HA ' ' O ' ' A' ' 71' ' ' SER . 17.5 m -72.4 -11.06 60.53 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.847 -173.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -79.5 -3.56 47.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.093 0.473 . . . . 0.0 110.584 176.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 26.0 p -132.42 -27.55 1.75 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.153 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.494 ' O ' ' HA ' ' A' ' 68' ' ' SER . 19.2 m -114.52 115.8 27.8 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 175.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -76.21 -29.25 57.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -173.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -62.86 131.43 48.76 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.586 0.708 . . . . 0.0 110.98 -169.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -62.99 -22.45 66.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.739 -172.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 -64.77 -22.19 66.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.959 0.409 . . . . 0.0 110.967 -177.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 53.1 m -111.01 25.98 11.19 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.999 -178.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -63.58 143.96 57.4 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.158 0.504 . . . . 0.0 110.641 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.582 ' ND2' ' HA ' ' A' ' 67' ' ' CYS . 0.3 OUTLIER -135.61 139.14 43.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.862 -177.046 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.47 ' HG ' ' N ' ' A' ' 80' ' ' LEU . 2.5 pt? -59.72 -52.26 66.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.216 -179.357 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.518 ' HG ' ' HB2' ' A' ' 83' ' ' TYR . 12.8 tp -86.93 74.74 9.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.304 0.574 . . . . 0.0 109.934 177.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -72.43 146.69 46.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.714 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.56 -8.94 76.64 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.606 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' TYR . . . . . 0.518 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 47.8 m-85 -123.65 164.84 18.27 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.478 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 12.6 m170 -128.33 146.79 61.08 Favored Pre-proline 0 CA--C 1.509 -0.616 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 172.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' PRO . . . . . 0.496 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 56.5 Cg_endo -75.55 138.47 21.78 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.114 1.876 . . . . 0.0 111.064 172.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.413 ' HD2' ' HD1' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -142.3 153.07 43.58 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.082 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.41 ' HG ' ' CD2' ' A' ' 57' ' ' LEU . 2.2 mm? -79.21 147.3 32.66 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.882 0.372 . . . . 0.0 110.517 -177.005 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 25.3 m -131.37 135.63 59.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.633 174.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.1 p -90.38 114.62 28.28 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-O 121.098 0.475 . . . . 0.0 110.832 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -119.38 95.74 4.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.494 178.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.74 -123.93 7.73 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.554 -1.018 . . . . 0.0 110.554 -174.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ARG . . . . . 0.572 ' HA ' ' HE3' ' A' ' 49' ' ' MET . 1.5 mpp_? -103.77 10.44 36.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.957 0.408 . . . . 0.0 110.33 173.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 24.8 m -116.11 135.91 53.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 78.1 mt -101.84 133.44 45.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.385 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -118.0 178.6 4.36 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -177.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.457 HD12 ' O ' ' A' ' 56' ' ' LYS . 53.3 mt -127.31 113.39 31.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 120.705 0.288 . . . . 0.0 110.944 -176.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 29.8 mm-40 -113.86 -173.89 2.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.01 179.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.478 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 10.3 m-85 -128.82 150.11 50.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.016 0.436 . . . . 0.0 111.926 -177.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.413 ' HD1' ' HD2' ' A' ' 86' ' ' LYS . 53.3 p90 -136.46 158.13 45.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.088 174.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -71.74 132.59 44.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.376 0.608 . . . . 0.0 111.862 -177.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 33.7 t -57.88 122.6 58.52 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.192 173.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.65 -23.14 70.07 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.419 2.079 . . . . 0.0 112.301 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.8 t -64.93 -19.74 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 121.239 0.542 . . . . 0.0 110.823 178.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.641 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.065 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ttt . . . . . 0 N--CA 1.485 1.285 0 CA-C-O 121.302 0.572 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 2' ' ' GLU . 0.2 OUTLIER -119.65 88.15 38.65 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.529 -177.666 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.501 ' O ' ' HG3' ' A' ' 6' ' ' ARG . 25.9 Cg_exo -61.11 111.54 1.12 Allowed 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.589 2.193 . . . . 0.0 112.009 -178.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 58.6 mt -74.07 -36.06 43.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.218 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -101.64 59.07 0.62 Allowed Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.782 177.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.501 ' HG3' ' O ' ' A' ' 3' ' ' PRO . 61.4 mtt85 -58.5 124.56 20.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.789 0.328 . . . . 0.0 110.924 178.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.0 m -85.11 -7.56 59.03 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.263 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.2 tt -78.12 68.22 4.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -137.94 111.02 7.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.452 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.44 131.39 13.16 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.424 -175.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.29 140.04 20.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.7 p -67.33 -16.6 64.35 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.061 0.458 . . . . 0.0 111.949 -174.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -82.4 92.17 1.57 Allowed Glycine 0 N--CA 1.442 -0.912 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.87 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -143.47 79.61 13.75 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 121.866 0.841 . . . . 0.0 111.255 178.028 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.512 ' HG2' ' HB3' ' A' ' 17' ' ' PHE . 62.3 Cg_endo -74.04 177.7 7.85 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.339 2.026 . . . . 0.0 111.138 172.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.611 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 22.0 t70 -60.67 -23.4 64.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.223 0.535 . . . . 0.0 109.984 177.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.512 ' HB3' ' HG2' ' A' ' 15' ' ' PRO . 92.0 t80 -52.78 -41.32 64.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.475 175.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.424 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -70.36 -29.46 66.14 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -178.297 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.611 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 46.9 mtpt -64.9 -39.8 94.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.943 177.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 23.7 mtp180 -66.17 -48.02 72.09 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 174.023 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.424 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 32.2 tp -54.32 -50.17 67.99 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.138 -1.392 . . . . 0.0 112.488 -177.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -71.98 -28.86 63.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.84 0.353 . . . . 0.0 110.873 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -70.66 -50.3 38.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.878 0.37 . . . . 0.0 110.082 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.677 ' HE1' HD23 ' A' ' 54' ' ' LEU . 23.1 ptm -67.23 -36.59 81.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.713 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -54.17 -50.57 66.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.115 176.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -68.45 -46.35 70.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.131 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mmmt -53.16 -44.77 68.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.507 HG21 ' O ' ' A' ' 24' ' ' MET . 93.4 t -63.62 -42.47 96.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.011 0.434 . . . . 0.0 110.076 177.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 64.5 mtt -81.81 17.7 1.45 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.138 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -118.39 -11.71 9.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.066 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.596 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 13.7 t70 -85.44 145.77 27.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.86 0.362 . . . . 0.0 110.449 -177.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 -75.46 -35.47 60.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.668 -173.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -68.97 -40.41 78.89 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.82 -43.93 85.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.834 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.596 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 75.4 mm-40 -56.25 -49.88 72.92 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.242 0.544 . . . . 0.0 110.346 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.45 -49.34 78.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.243 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -63.91 -41.95 97.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.222 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 1.1 mm? -55.52 -51.42 67.07 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.105 -178.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.449 ' HB3' ' HE2' ' A' ' 39' ' ' LYS . 15.5 ptpt -74.67 -24.39 58.79 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.901 0.381 . . . . 0.0 110.99 -177.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -63.79 -46.2 86.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.307 0.575 . . . . 0.0 110.378 177.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -114.88 26.45 10.15 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.665 -176.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.408 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 10.8 pt-20 -67.89 -18.19 64.72 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.835 0.35 . . . . 0.0 111.501 -176.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -73.45 -26.46 60.95 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.287 0.565 . . . . 0.0 109.794 175.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.7 t -99.2 -42.58 10.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.056 -176.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.4 mt -80.15 144.2 11.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.378 -175.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -114.31 163.31 15.46 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.936 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -55.22 -43.15 74.24 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.309 0.576 . . . . 0.0 111.265 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -69.55 -36.31 76.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.287 -178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.416 ' HE1' ' HA ' ' A' ' 92' ' ' ARG . 57.8 ttm -56.13 -38.59 71.03 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.529 174.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.6 mm -61.77 -47.25 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.988 177.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 46.3 mt-10 -70.91 -30.62 67.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.499 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -70.68 -43.59 68.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.671 0.272 . . . . 0.0 110.752 176.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.0 m -92.92 19.61 7.54 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.41 -179.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.677 HD23 ' HE1' ' A' ' 24' ' ' MET . 0.5 OUTLIER -51.74 -51.72 54.02 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.13 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -52.94 -45.08 67.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.579 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.467 ' O ' HD13 ' A' ' 96' ' ' ILE . 38.3 mmtm -63.68 -53.69 47.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.211 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.36 -33.58 75.84 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.695 -177.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 42.9 t80 -73.65 -41.0 63.3 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.871 0.367 . . . . 0.0 110.477 178.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.456 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 42.1 tt0 -65.88 -33.04 74.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.495 0.664 . . . . 0.0 109.882 177.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -58.71 -51.61 69.24 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.6 177.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.0 pt -75.17 -28.25 20.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.876 -176.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.83 -33.06 64.0 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.031 -175.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 47.5 mt-30 -81.02 179.48 7.84 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.875 0.369 . . . . 0.0 111.145 -178.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.1 t -66.65 117.06 8.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.692 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -75.23 -27.0 59.35 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.394 0.616 . . . . 0.0 110.175 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -102.55 -160.89 0.81 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.41 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -154.46 157.84 39.03 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 177.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.6 t -79.21 -9.83 59.67 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.194 0.521 . . . . 0.0 110.703 -172.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -69.69 -11.56 60.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.211 0.529 . . . . 0.0 110.604 173.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 17.8 p -126.49 -40.33 1.95 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.255 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.2 m -99.0 153.44 18.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.1 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.44 16.12 6.92 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.229 0.538 . . . . 0.0 110.691 178.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -68.16 86.21 0.26 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.833 176.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -80.41 -11.27 59.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.055 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -81.1 -13.42 58.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.615 -175.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 66.9 m -87.96 115.53 25.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.516 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -78.06 108.11 11.1 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.245 177.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -120.12 135.63 54.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.817 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.662 ' HG ' HD23 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -104.29 -35.93 7.8 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.166 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.662 HD23 ' HG ' ' A' ' 79' ' ' LEU . 3.2 mm? -87.12 49.19 1.77 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.976 170.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -67.41 147.5 52.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.33 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 94.0 -9.03 73.14 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.467 -173.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.412 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 56.2 m-85 -125.0 171.81 9.93 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 99' ' ' TYR . 16.9 m170 -130.5 147.48 66.11 Favored Pre-proline 0 C--N 1.329 -0.291 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 171.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.96 135.49 15.64 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.363 2.042 . . . . 0.0 112.472 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -136.95 146.33 45.27 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 172.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.6 mt -80.72 142.95 33.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.802 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 23.2 m -139.94 141.36 34.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.938 175.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.1 p -93.37 114.68 30.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.498 0.666 . . . . 0.0 110.454 179.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -116.0 96.68 5.69 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.676 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.95 -112.98 4.71 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.665 -177.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.481 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 8.0 mpt_? -106.85 0.9 24.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.909 0.385 . . . . 0.0 110.965 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 12.2 p -121.5 147.58 45.59 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.006 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 55.9 mt -103.66 124.57 58.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.956 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -109.77 177.62 4.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.245 0.545 . . . . 0.0 110.839 -175.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.467 HD13 ' O ' ' A' ' 56' ' ' LYS . 47.4 mt -126.53 105.88 14.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.283 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -105.46 150.75 25.02 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.237 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.412 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 17.2 m-85 -100.17 126.87 46.49 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.056 179.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.437 ' CZ ' ' HB2' ' A' ' 84' ' ' HIS . 54.3 p90 -105.49 144.34 32.39 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 173.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -63.2 138.71 58.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.111 0.481 . . . . 0.0 111.069 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 40.6 t -56.63 123.37 57.0 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.456 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.07 -17.15 58.78 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.815 2.343 . . . . 0.0 112.213 -178.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.9 t -69.63 -15.76 19.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.827 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -67.75 -22.91 65.2 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 17.1 mmm180 -95.45 126.74 40.96 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.429 176.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? . . . . . 0 C--N 1.318 -0.773 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.022 175.776 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.0 tpt . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 120.861 0.363 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -127.65 153.13 77.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.684 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.58 135.11 37.76 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.52 2.147 . . . . 0.0 112.021 176.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.717 HG21 ' H ' ' A' ' 6' ' ' ARG . 4.3 mp -88.46 135.55 25.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -68.08 -12.41 62.78 Favored Glycine 0 CA--C 1.52 0.382 0 C-N-CA 121.143 -0.551 . . . . 0.0 113.25 -176.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.717 ' H ' HG21 ' A' ' 4' ' ' ILE . 16.5 ptp180 -128.67 102.17 6.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.4 0.619 . . . . 0.0 110.2 178.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.1 p -73.38 -18.05 61.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.615 -177.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.433 ' N ' HD12 ' A' ' 8' ' ' LEU . 5.2 mp -74.79 -18.4 60.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.343 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.413 ' HB3' ' H ' ' A' ' 10' ' ' GLY . 24.7 mm-40 -141.5 -154.64 0.53 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.946 -177.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.413 ' H ' ' HB3' ' A' ' 9' ' ' GLN . . . 91.05 -65.53 2.57 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.454 175.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 5.2 m -108.42 94.6 3.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.609 0.719 . . . . 0.0 111.244 -178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 p -98.38 86.27 3.59 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.678 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 149.48 109.91 0.52 Allowed Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.596 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.446 ' HA ' ' HD2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -154.45 87.53 3.48 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-O 120.709 0.29 . . . . 0.0 110.466 -178.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 14' ' ' ARG . 4.8 Cg_endo -48.02 144.74 11.62 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 123.184 2.59 . . . . 0.0 112.061 178.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.472 ' HA ' ' HB2' ' A' ' 19' ' ' LYS . 2.9 m-20 -76.63 -3.3 37.07 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -171.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -65.16 -54.89 22.82 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.468 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 3.2 pt20 -66.88 -30.23 70.34 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.41 178.145 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.472 ' HB2' ' HA ' ' A' ' 16' ' ' ASP . 5.9 mmmm -57.98 -48.41 80.06 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 174.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' A' ' 24' ' ' MET . 2.6 tpp180 -66.57 -45.2 80.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.385 177.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.468 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 26.8 tp -53.94 -49.42 68.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.319 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -67.02 -40.36 87.24 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.922 177.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.412 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 27.3 tt0 -59.29 -51.33 70.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.827 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.557 ' HE3' HD13 ' A' ' 54' ' ' LEU . 18.1 ptm -73.55 -37.37 65.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.078 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.483 ' HE2' ' HG2' ' A' ' 51' ' ' GLU . 4.5 tppp? -59.76 -40.51 88.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 110.143 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.68 -50.53 70.78 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.323 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -58.14 -47.0 84.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.524 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.514 ' HA ' HD12 ' A' ' 61' ' ' ILE . 74.8 t -62.66 -42.23 95.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.063 -177.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.434 ' HE3' HG22 ' A' ' 50' ' ' ILE . 24.3 mmt -82.98 15.52 2.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.751 0.31 . . . . 0.0 111.279 -178.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -107.27 -20.38 13.3 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.083 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.672 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 35.1 t70 -77.37 131.36 38.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.937 0.399 . . . . 0.0 111.237 -175.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -59.45 -45.61 91.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.808 -177.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.422 ' CG ' ' HZ2' ' A' ' 65' ' ' LYS . 5.6 m-20 -67.56 -39.43 84.93 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.423 -177.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.8 t -54.83 -49.61 68.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.661 174.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.672 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 36.0 mt-30 -64.38 -40.41 95.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.232 0.539 . . . . 0.0 110.607 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -59.77 -38.85 82.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.33 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.411 ' CZ ' HG23 ' A' ' 89' ' ' VAL . 59.3 t80 -69.82 -44.26 70.33 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.735 177.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.502 HD12 HD11 ' A' ' 50' ' ' ILE . 1.2 mm? -54.41 -47.91 72.23 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.355 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.6 pttt -76.11 -27.06 56.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.028 0.442 . . . . 0.0 111.114 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 5.3 tp10 -65.57 -42.45 91.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.134 0.492 . . . . 0.0 110.124 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -116.01 27.67 9.11 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.161 -176.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -66.94 -16.1 64.11 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.971 0.415 . . . . 0.0 111.734 -175.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -77.85 -19.41 54.91 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.109 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 40.4 t -113.68 -40.74 3.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.992 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.634 HG12 HG22 ' A' ' 89' ' ' VAL . 62.4 mt -72.09 141.92 15.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.499 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -115.48 164.1 14.78 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.461 -0.79 . . . . 0.0 108.87 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -59.92 -40.19 88.01 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -64.88 -38.17 90.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.648 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.6 tpp -58.73 -41.75 87.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.325 177.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.502 HD11 HD12 ' A' ' 38' ' ' LEU . 44.6 mm -61.95 -45.81 97.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.856 178.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.575 ' HA ' HD21 ' A' ' 54' ' ' LEU . 34.2 mt-10 -70.35 -33.85 71.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.126 -178.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -64.07 -41.52 97.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.125 0.488 . . . . 0.0 110.123 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.4 m -107.18 27.46 9.02 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.087 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.575 HD21 ' HA ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -55.29 -46.21 76.21 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 121.151 0.501 . . . . 0.0 110.024 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -63.72 -29.64 70.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.017 -176.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.472 ' O ' HD12 ' A' ' 96' ' ' ILE . 65.0 mmtt -68.19 -53.98 21.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.092 0.473 . . . . 0.0 110.103 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.2 mp -65.63 -36.74 84.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.724 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -65.83 -42.16 90.87 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.18 -0.463 . . . . 0.0 109.898 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -58.07 -48.21 80.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.619 175.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -56.13 -49.26 74.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.47 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.514 HD12 ' HA ' ' A' ' 28' ' ' VAL . 29.7 pt -75.13 -29.55 21.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -174.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -80.39 -30.69 37.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.661 0.267 . . . . 0.0 111.3 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -77.91 -171.78 2.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.159 0.504 . . . . 0.0 110.926 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 31.6 p -74.38 94.03 2.49 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.463 177.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.422 ' HZ2' ' CG ' ' A' ' 33' ' ' ASP . 18.1 ttmm -64.45 -32.93 74.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.614 0.721 . . . . 0.0 109.399 173.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.477 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.0 t-20 -92.22 -159.93 0.7 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.128 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.481 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -153.95 149.57 27.41 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.447 175.604 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.475 ' HA ' ' O ' ' A' ' 71' ' ' SER . 13.7 t -75.21 0.65 15.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.82 -173.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.422 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 5.3 t80 -82.41 -12.68 57.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.199 176.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.477 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 25.6 p -127.53 -40.81 1.75 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.57 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.475 ' O ' ' HA ' ' A' ' 68' ' ' SER . 50.2 p -98.34 149.29 22.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 174.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 14.9 tt0 -102.35 -2.93 27.93 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.782 -176.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.517 ' HB2' HD21 ' A' ' 75' ' ' ASN . 1.8 p30 -58.33 133.25 55.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.469 0.652 . . . . 0.0 110.557 -176.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -94.76 5.44 51.86 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.334 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.517 HD21 ' HB2' ' A' ' 73' ' ' ASP . 53.2 m-80 -68.55 -39.74 80.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.889 -177.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 21.8 p -110.44 114.56 28.09 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.965 0.412 . . . . 0.0 110.181 176.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -74.86 107.47 6.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.676 0.751 . . . . 0.0 109.908 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.699 ' OD1' ' HA ' ' A' ' 81' ' ' GLU . 2.9 t-20 -87.98 103.75 15.98 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.772 -176.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 mp -65.53 -65.53 0.66 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.251 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.2 mp -80.4 77.14 7.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.348 174.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.699 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 29.8 tt0 -73.95 132.54 42.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.598 -175.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.14 -7.53 48.13 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.357 -176.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -122.29 162.91 20.61 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -126.04 147.22 58.49 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 169.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.78 136.79 28.52 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.315 2.01 . . . . 0.0 112.358 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.476 ' HB3' ' CD1' ' A' ' 99' ' ' TYR . 20.6 ptmt -128.11 131.72 49.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.416 179.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 76.2 mt -78.92 134.66 36.86 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.177 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.2 m -132.18 139.68 49.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.121 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.634 HG22 HG12 ' A' ' 45' ' ' ILE . 78.8 t -88.98 114.67 27.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.405 0.621 . . . . 0.0 109.673 175.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -117.05 95.32 4.94 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.133 -172.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.17 -113.94 6.29 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.062 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.518 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 0.2 OUTLIER -105.7 18.34 22.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.752 0.31 . . . . 0.0 111.386 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.3 m -138.98 167.62 21.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.09 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 76.2 mt -114.68 131.71 66.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -115.62 177.57 4.62 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 -176.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.472 HD12 ' O ' ' A' ' 56' ' ' LYS . 51.0 mt -132.98 108.88 13.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.285 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -99.55 -174.93 2.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.809 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -133.37 124.26 26.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.927 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.476 ' CD1' ' HB3' ' A' ' 86' ' ' LYS . 55.2 p90 -107.22 152.12 24.52 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.14 130.29 39.49 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.417 0.627 . . . . 0.0 110.616 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 48.9 t -46.31 122.88 6.75 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.587 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -60.51 -9.58 11.45 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.132 2.555 . . . . 0.0 113.099 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 91.8 t -78.44 -25.23 13.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 177.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -65.83 -41.28 91.98 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -135.47 87.95 2.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.126 172.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp . . . . . 0 C--N 1.321 -0.664 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.78 -179.09 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.0 mtp . . . . . 0 N--CA 1.479 0.977 0 CA-C-O 121.052 0.454 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -102.29 148.55 35.59 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.64 -174.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -74.9 158.4 42.61 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.484 2.123 . . . . 0.0 112.018 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.0 tp -73.74 128.33 36.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.177 0.513 . . . . 0.0 110.746 -178.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.435 ' C ' ' HD2' ' A' ' 6' ' ' ARG . . . -88.07 -134.09 4.49 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.293 -179.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.598 ' HB3' ' HG ' ' A' ' 8' ' ' LEU . 3.8 mpt_? -124.26 162.54 23.51 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.916 0.388 . . . . 0.0 110.714 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.2 m -77.62 -13.31 59.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.805 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.598 ' HG ' ' HB3' ' A' ' 6' ' ' ARG . 2.8 pp -82.47 9.71 8.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.351 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -55.01 -44.71 74.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.173 -177.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -114.35 36.61 3.9 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.364 -0.922 . . . . 0.0 113.171 -174.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 29.9 m -131.71 164.57 34.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.853 0.326 . . . . 0.0 110.389 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.4 t -79.39 39.87 0.41 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.773 0.797 . . . . 0.0 110.662 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -112.42 25.75 11.91 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.091 -179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.404 ' HA ' ' HD2' ' A' ' 15' ' ' PRO . 1.7 ppt_? -149.58 85.73 5.64 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 121.321 0.582 . . . . 0.0 110.713 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 14' ' ' ARG . 15.1 Cg_endo -56.52 168.93 1.9 Allowed 'Trans proline' 0 C--O 1.237 0.461 0 C-N-CA 123.881 3.054 . . . . 0.0 113.929 -176.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.93 -23.78 54.96 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.726 -178.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -52.46 -46.97 66.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.2 177.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.41 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -71.43 -30.06 65.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.243 0.544 . . . . 0.0 110.04 -177.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -71.13 -42.54 69.08 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.382 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -72.52 -32.26 65.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.751 0.31 . . . . 0.0 110.577 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 tp -65.22 -49.48 69.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.388 177.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.534 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 7.0 mm-40 -73.18 -25.0 60.62 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.923 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -61.96 -56.91 14.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.759 0.314 . . . . 0.0 111.398 174.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.615 ' HE3' HD12 ' A' ' 54' ' ' LEU . 23.7 ptm -61.14 -35.56 77.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.956 0.407 . . . . 0.0 109.995 176.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.534 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 4.1 tptm -57.78 -46.18 84.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.923 173.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.465 ' CD ' ' HZ3' ' A' ' 30' ' ' LYS . 8.0 tp10 -53.11 -49.25 66.87 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 123.665 0.786 . . . . 0.0 111.103 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.408 ' HE2' ' HB3' ' A' ' 27' ' ' LYS . 11.5 mmmm -59.02 -49.42 77.97 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.783 177.248 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.512 HG21 ' O ' ' A' ' 24' ' ' MET . 57.6 t -64.18 -41.24 91.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.723 -175.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 14.8 ptp -73.73 -4.72 36.23 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -171.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.465 ' HZ3' ' CD ' ' A' ' 26' ' ' GLU . 6.2 mtpt -127.62 -4.08 5.95 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.471 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 0.3 OUTLIER -77.38 126.74 31.39 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.179 0.514 . . . . 0.0 110.239 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -66.68 -33.01 74.7 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.972 -168.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -66.46 -41.23 89.37 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.789 0.328 . . . . 0.0 110.236 177.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 91.3 t -58.28 -44.82 88.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.289 172.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 84.4 mm-40 -55.38 -50.47 69.64 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.922 178.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -54.67 -42.62 71.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.26 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -68.85 -43.44 75.45 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.692 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.697 HD11 HD12 ' A' ' 50' ' ' ILE . 2.4 mm? -61.03 -44.7 97.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.445 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 ptmm? -70.83 -26.05 63.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.045 0.45 . . . . 0.0 110.508 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -73.85 -44.23 56.16 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.974 0.416 . . . . 0.0 110.588 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -112.74 29.02 8.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.505 -176.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -64.22 -22.54 66.98 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.031 0.444 . . . . 0.0 111.354 -176.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -75.11 -25.99 58.91 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.534 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.5 t -101.07 -42.37 9.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.99 -174.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.532 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 65.3 mt -77.87 142.63 13.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.794 -175.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -118.24 165.7 13.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.707 176.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -55.68 -44.33 77.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.901 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.401 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 51.6 mtpt -66.14 -36.89 84.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.086 0.469 . . . . 0.0 110.706 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.696 ' HE1' HG21 ' A' ' 89' ' ' VAL . 23.0 ttt -60.13 -35.83 76.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.201 177.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.697 HD12 HD11 ' A' ' 38' ' ' LEU . 37.0 mm -64.57 -54.45 30.24 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.839 176.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.494 ' HA ' HD22 ' A' ' 54' ' ' LEU . 7.7 mm-40 -57.53 -42.18 82.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.024 0.44 . . . . 0.0 111.014 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -65.36 -29.73 70.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.082 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.439 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 7.3 m -114.26 20.5 15.49 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.38 -178.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.615 HD12 ' HE3' ' A' ' 24' ' ' MET . 0.1 OUTLIER -58.88 -44.7 91.19 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.922 -177.633 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -60.6 -33.67 73.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.782 178.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.565 ' O ' HD12 ' A' ' 96' ' ' ILE . 32.1 mmmt -73.22 -42.76 62.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 110.91 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.458 HD23 HG23 ' A' ' 94' ' ' ILE . 76.2 mt -65.51 -38.79 90.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.143 0.497 . . . . 0.0 110.132 177.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -70.3 -39.26 74.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.115 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.504 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 38.0 tt0 -57.21 -39.72 76.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.012 175.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -59.51 -52.21 66.55 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.525 177.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.7 pt -74.34 -29.0 23.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -174.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.504 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 7.6 pt-20 -75.63 -20.73 58.31 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.811 178.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 46.3 mt-30 -74.36 -167.15 0.49 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.925 0.393 . . . . 0.0 110.322 174.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.549 ' HB2' ' C ' ' A' ' 77' ' ' ASN . 20.0 t -83.74 130.16 34.95 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.881 0.372 . . . . 0.0 111.212 -177.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -73.05 -26.6 61.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.533 0.682 . . . . 0.0 109.574 173.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.48 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 76.6 m-20 -122.78 -160.09 0.87 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.608 -177.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.435 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 6.8 p -152.63 161.11 43.01 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 176.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.581 ' HB3' ' HG3' ' A' ' 81' ' ' GLU . 48.1 t -60.24 -29.22 68.63 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 123.49 0.494 . . . . 0.0 111.285 -174.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -72.37 -1.92 17.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.032 0.444 . . . . 0.0 111.617 -178.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.9 p -136.31 6.94 3.08 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.591 175.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 38.5 t -145.35 118.65 8.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.865 0.364 . . . . 0.0 110.302 -176.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -81.81 -6.69 59.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.03 177.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -79.73 134.13 36.37 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.019 -174.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -64.28 -26.4 68.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.079 -0.51 . . . . 0.0 112.328 -176.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -81.49 67.45 7.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.824 0.821 . . . . 0.0 110.238 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.45 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 15.7 p -115.51 116.92 29.0 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.454 172.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.549 ' C ' ' HB2' ' A' ' 64' ' ' SER . 56.4 m-20 -79.08 21.81 0.43 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.653 -173.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.45 ' OD1' ' HB2' ' A' ' 76' ' ' CYS . 3.0 p-10 -103.66 128.06 51.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.153 0.501 . . . . 0.0 111.272 -177.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.839 ' HG ' HD11 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -90.73 -26.89 19.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 168.869 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.839 HD11 ' HG ' ' A' ' 79' ' ' LEU . 5.5 mp -85.51 110.3 19.1 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.258 173.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.581 ' HG3' ' HB3' ' A' ' 68' ' ' SER . 33.5 tt0 -88.48 142.05 28.03 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.091 0.472 . . . . 0.0 110.541 -179.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.2 -8.78 77.44 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.887 176.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -126.43 160.3 30.89 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.919 0.359 . . . . 0.0 110.989 -177.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.48 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 13.1 m170 -128.07 149.32 70.67 Favored Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.005 177.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.98 153.54 25.33 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.548 2.166 . . . . 0.0 112.166 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -152.6 151.96 31.25 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -82.57 142.65 31.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.964 0.411 . . . . 0.0 110.346 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.483 ' CG2' ' HB3' ' A' ' 95' ' ' ASP . 33.1 m -132.49 155.42 41.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.622 176.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.696 HG21 ' HE1' ' A' ' 49' ' ' MET . 4.3 p -99.92 115.15 40.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-O 121.168 0.508 . . . . 0.0 110.08 175.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -120.17 95.82 4.9 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.866 177.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.64 -124.11 28.41 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.088 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -96.59 13.9 26.61 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.83 0.348 . . . . 0.0 111.0 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.5 m -125.24 144.42 50.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.663 -178.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.458 HG23 HD23 ' A' ' 57' ' ' LEU . 60.8 mt -97.56 131.78 43.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 174.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.483 ' HB3' ' CG2' ' A' ' 88' ' ' VAL . 41.3 t0 -126.46 178.08 6.08 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.745 0.307 . . . . 0.0 110.254 -170.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.565 HD12 ' O ' ' A' ' 56' ' ' LYS . 77.0 mt -124.39 129.94 73.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-O 121.249 0.547 . . . . 0.0 110.273 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -122.49 172.33 8.44 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.283 177.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -124.42 134.99 52.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.008 0.432 . . . . 0.0 111.268 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -118.21 151.2 38.08 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.561 ' HG2' ' HD3' ' A' ' 104' ' ' LYS . 24.4 tt0 -71.84 137.19 47.36 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.979 0.419 . . . . 0.0 110.582 -175.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.452 ' SG ' HG11 ' A' ' 103' ' ' VAL . 19.8 t -47.58 124.8 9.8 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.505 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.37 -10.91 25.74 Favored 'Trans proline' 0 N--CA 1.474 0.337 0 C-N-CA 123.198 2.599 . . . . 0.0 113.493 -176.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.452 HG11 ' SG ' ' A' ' 101' ' ' CYS . 9.8 p -66.61 -19.39 25.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.282 0.563 . . . . 0.0 110.306 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.658 ' HB3' ' HZ3' ' A' ' 104' ' ' LYS . 8.3 mtpm? -80.86 -10.08 59.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.219 -178.053 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 38.2 ttm-85 -136.43 90.44 2.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.853 0.359 . . . . 0.0 110.094 174.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.459 -179.938 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.483 1.179 0 CA-C-O 120.892 0.377 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -116.32 87.34 19.78 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.277 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -70.38 97.59 0.7 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.303 2.002 . . . . 0.0 112.025 -178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.5 mm -107.69 -43.5 6.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.113 178.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -91.02 144.24 17.1 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.056 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 59.8 mtm180 -103.73 145.83 29.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.669 0.271 . . . . 0.0 110.317 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.4 m -74.9 80.63 2.15 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.311 0.576 . . . . 0.0 111.332 -178.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 33.3 tp -101.53 6.6 42.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.59 0.71 . . . . 0.0 109.848 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -100.42 111.89 24.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.054 -178.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -127.17 41.77 1.56 Allowed Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.14 177.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.4 t -100.34 148.62 6.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.414 -0.393 . . . . 0.0 110.242 -176.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.3 t -78.02 12.05 1.98 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.45 0.643 . . . . 0.0 110.94 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -119.36 125.72 6.47 Favored Glycine 0 N--CA 1.447 -0.611 0 N-CA-C 111.19 -0.764 . . . . 0.0 111.19 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -142.61 79.65 15.02 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 117.03 0.415 . . . . 0.0 110.853 -176.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -69.85 114.42 3.71 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.613 2.209 . . . . 0.0 111.701 173.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -71.5 -32.46 68.25 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.518 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -52.17 -47.64 65.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.537 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 1.7 pt20 -68.88 -30.75 69.32 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.208 -175.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 30.3 mmtm -72.13 -38.16 69.32 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -175.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.1 ptt85 -75.52 -23.78 56.73 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.444 176.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.4 tp -70.48 -48.57 55.12 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.12 174.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 18' ' ' GLN . 37.0 mt-10 -58.92 -43.2 91.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.884 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -58.29 -53.71 55.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.999 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.596 ' O ' HG22 ' A' ' 28' ' ' VAL . 26.3 ptm -68.68 -42.3 78.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.287 -177.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -61.25 -43.06 99.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.719 0.295 . . . . 0.0 110.777 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -64.88 -46.4 81.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.059 0.457 . . . . 0.0 110.173 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -55.75 -45.39 78.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.949 178.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.596 HG22 ' O ' ' A' ' 24' ' ' MET . 74.3 t -62.08 -37.54 78.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.939 0.4 . . . . 0.0 110.79 -179.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.8 mtp -82.3 -2.97 54.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.59 -178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -103.8 -6.57 21.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.305 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 26.1 t70 -77.93 137.61 38.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.824 0.345 . . . . 0.0 110.489 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -67.57 -43.47 80.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.483 -175.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -70.42 -43.67 69.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.53 -177.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.9 t -54.99 -55.18 17.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.855 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.421 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 2.1 pt20 -65.61 -34.21 77.7 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -176.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.91 -41.61 86.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.265 0.555 . . . . 0.0 110.192 175.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -61.8 -38.94 89.99 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.812 176.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.793 HD12 HD12 ' A' ' 50' ' ' ILE . 1.6 mm? -61.25 -50.47 72.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.794 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -70.0 -23.1 63.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.025 0.44 . . . . 0.0 111.054 -177.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -76.15 -37.52 57.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.958 176.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -110.71 25.18 12.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.701 -174.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -63.67 -20.78 65.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.076 0.465 . . . . 0.0 111.311 -176.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -75.5 -20.44 58.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.574 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.4 t -108.06 -46.98 7.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.802 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.459 HD12 HG21 ' A' ' 89' ' ' VAL . 54.6 mt -81.33 144.16 10.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.979 -173.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.481 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -130.83 -178.65 4.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.442 176.454 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -64.36 -42.25 96.31 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -60.03 -44.79 94.39 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.589 0.233 . . . . 0.0 110.609 177.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.429 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 38.5 ttm -56.25 -38.95 71.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.537 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.793 HD12 HD12 ' A' ' 38' ' ' LEU . 46.1 mm -60.52 -54.12 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.945 177.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -62.09 -38.11 87.63 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.129 0.49 . . . . 0.0 111.068 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -69.68 -26.46 64.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.608 -178.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 77.3 p -114.37 16.48 17.82 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.265 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.464 HD23 ' HE3' ' A' ' 24' ' ' MET . 0.7 OUTLIER -53.94 -42.68 69.09 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.456 0.646 . . . . 0.0 110.508 178.296 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.502 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 24.4 p-10 -59.67 -44.46 93.59 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.738 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.563 ' O ' HD13 ' A' ' 96' ' ' ILE . 31.1 mmmt -67.48 -49.94 61.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.557 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.6 -41.07 76.39 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.531 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -67.39 -42.77 82.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.072 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 15.9 mm-40 -58.87 -39.36 81.12 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-O 120.9 0.381 . . . . 0.0 110.763 177.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -58.88 -51.33 70.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.531 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.6 pt -71.64 -29.69 35.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.702 -174.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.75 -23.25 55.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.014 0.435 . . . . 0.0 111.093 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 46.9 mt-30 -80.26 167.75 19.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.048 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.2 m -66.9 113.4 4.92 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.52 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -64.83 -26.19 68.23 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.781 172.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -102.19 -163.18 0.98 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.664 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.7 p -159.6 158.04 30.9 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.0 m -67.32 -25.4 66.0 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.067 0.461 . . . . 0.0 110.775 -172.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.496 ' CE2' ' HB3' ' A' ' 104' ' ' LYS . 1.3 t80 -67.76 -5.89 18.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.57 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 28.7 p -135.92 2.63 2.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.749 0.309 . . . . 0.0 111.1 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.8 m -124.33 145.27 49.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.898 0.38 . . . . 0.0 110.16 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -77.26 -13.55 59.92 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.271 0.557 . . . . 0.0 110.844 -175.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.746 ' HB3' ' HG ' ' A' ' 76' ' ' CYS . 0.3 OUTLIER -80.13 87.06 5.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.435 179.561 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -68.37 -11.13 59.11 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.583 0.706 . . . . 0.0 110.151 175.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -73.71 -17.58 61.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.218 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.746 ' HG ' ' HB3' ' A' ' 73' ' ' ASP . 59.8 m -71.27 117.4 12.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.892 0.377 . . . . 0.0 111.023 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -87.31 99.83 12.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.996 0.427 . . . . 0.0 110.007 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -102.05 129.75 48.44 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.499 -177.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.461 ' HG ' HD13 ' A' ' 80' ' ' LEU . 2.5 pt? -66.9 -24.35 66.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.415 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.461 HD13 ' HG ' ' A' ' 79' ' ' LEU . 5.3 mp -141.96 103.84 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 174.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -94.69 150.49 20.17 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 -176.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.52 -9.41 77.18 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.389 -174.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -124.18 166.99 14.88 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.7 m170 -127.62 146.84 60.12 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 169.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.3 145.77 39.13 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.063 1.842 . . . . 0.0 111.513 175.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -142.03 149.63 40.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.096 177.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.7 mt -83.59 135.59 34.56 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.058 177.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.415 HG11 ' HG3' ' A' ' 97' ' ' GLU . 29.7 m -133.81 150.63 31.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.515 HG23 HG12 ' A' ' 94' ' ' ILE . 48.4 t -109.84 112.67 41.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.341 0.591 . . . . 0.0 109.499 172.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -108.87 104.07 13.25 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.798 -177.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.74 -105.03 1.42 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.833 -0.699 . . . . 0.0 111.525 -177.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -117.21 5.06 12.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.737 0.303 . . . . 0.0 110.575 178.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.6 p -122.29 138.02 54.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.789 0.328 . . . . 0.0 111.392 -176.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.515 HG12 HG23 ' A' ' 89' ' ' VAL . 66.1 mt -90.53 137.52 21.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.848 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -134.38 178.86 6.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.808 0.337 . . . . 0.0 110.774 -176.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.563 HD13 ' O ' ' A' ' 56' ' ' LYS . 51.8 mt -123.49 110.61 26.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.354 -177.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.415 ' HG3' HG11 ' A' ' 88' ' ' VAL . 7.0 mm-40 -102.83 179.45 4.28 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.24 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -128.25 133.56 48.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.586 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -115.91 140.59 49.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.007 174.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -56.82 127.11 30.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.906 178.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.2 t -52.71 122.31 26.4 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.792 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -63.02 -1.12 2.56 Favored 'Trans proline' 0 N--CA 1.476 0.494 0 C-N-CA 123.37 2.713 . . . . 0.0 113.432 -176.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.8 t -79.83 -44.3 23.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.412 175.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.496 ' HB3' ' CE2' ' A' ' 69' ' ' TYR . 14.7 ptmm? -82.3 -21.81 35.96 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.853 0.359 . . . . 0.0 110.874 -178.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 43.6 ttm105 -139.51 99.86 3.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.107 0.48 . . . . 0.0 109.954 174.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.4 tttm . . . . . 0 C--N 1.319 -0.722 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.395 -178.143 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.2 tpt . . . . . 0 N--CA 1.478 0.952 0 CA-C-O 120.931 0.396 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -96.09 156.5 37.01 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.725 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.09 91.4 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.455 2.104 . . . . 0.0 111.432 175.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 68.1 mt -125.4 116.06 45.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.453 -177.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 98.9 137.74 9.96 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.823 177.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 21.2 tpp85 -109.91 107.47 17.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.935 0.398 . . . . 0.0 110.289 176.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.1 t -140.76 141.75 34.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.209 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.485 HD11 ' O ' ' A' ' 8' ' ' LEU . 2.0 tm? -73.36 -27.16 61.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -83.77 42.1 0.83 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.544 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -77.76 67.69 2.88 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.431 -177.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.78 94.23 4.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 175.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.1 m -73.89 97.1 2.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.769 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 80.95 138.5 2.26 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.74 177.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.446 ' HD3' ' N ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -155.04 78.62 4.77 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 121.449 0.642 . . . . 0.0 110.383 175.839 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.95 155.73 68.6 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.374 2.049 . . . . 0.0 112.16 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.404 ' OD2' ' HD2' ' A' ' 20' ' ' ARG . 16.2 t70 -53.2 -32.37 47.66 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.278 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -53.74 -56.12 20.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.17 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.416 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -72.11 -30.64 65.28 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.208 -176.818 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt -67.56 -46.5 72.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.475 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.487 ' O ' ' HG2' ' A' ' 24' ' ' MET . 11.4 ptm180 -71.15 -26.59 63.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.0 tp -68.69 -48.82 62.93 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.973 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 11.6 pt-20 -70.77 -30.58 67.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.75 0.309 . . . . 0.0 110.59 175.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -64.73 -53.89 40.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.697 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.487 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 12.0 ptp -61.79 -38.65 88.89 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.464 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.46 ' O ' ' HG2' ' A' ' 29' ' ' MET . 4.3 tppp? -56.15 -50.26 71.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.323 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.24 -49.93 75.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.635 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -52.01 -51.84 54.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.773 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.44 ' CG1' HG12 ' A' ' 34' ' ' VAL . 84.7 t -62.8 -34.42 65.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.326 -177.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.46 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.7 mmt -73.74 -8.93 57.92 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.452 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -102.94 -8.64 20.51 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -176.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.412 ' CG ' ' HZ1' ' A' ' 65' ' ' LYS . 33.5 t70 -85.28 131.15 34.46 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.391 -175.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.36 -42.06 98.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.152 -178.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -68.99 -45.4 70.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.018 0.437 . . . . 0.0 110.438 -175.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.44 HG12 ' CG1' ' A' ' 28' ' ' VAL . 44.7 t -56.85 -55.41 20.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.534 178.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -65.3 -31.64 72.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.799 0.333 . . . . 0.0 111.447 -176.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.2 -42.34 88.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.977 0.418 . . . . 0.0 110.526 174.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -65.75 -37.57 86.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.734 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 38' ' ' LEU . 1.3 mm? -57.85 -44.89 86.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.242 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.531 ' HZ1' ' HB2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -80.04 -24.21 40.89 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.77 0.319 . . . . 0.0 110.681 179.673 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.88 -49.89 73.07 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.313 0.578 . . . . 0.0 110.343 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -115.62 31.42 6.72 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.273 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.88 -23.41 65.16 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -175.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -85.13 -25.45 27.47 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.222 0.535 . . . . 0.0 110.661 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.4 t -96.12 -40.83 11.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.117 -174.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.7 mt -70.53 140.54 18.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.836 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -91.92 151.02 20.72 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.53 176.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -61.4 -36.28 79.86 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -63.61 -43.06 98.0 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.321 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.469 ' HE1' ' HA ' ' A' ' 92' ' ' ARG . 45.2 ttm -55.63 -37.87 68.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.9 178.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.6 mm -63.24 -49.11 84.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.866 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -58.47 -38.04 76.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.264 0.554 . . . . 0.0 110.777 178.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -77.68 -29.96 51.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.476 -176.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 m -106.06 11.68 31.21 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -174.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.8 tp -57.33 -38.1 73.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.867 0.365 . . . . 0.0 110.656 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -60.21 -39.43 86.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.089 177.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -69.9 -43.02 72.59 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.966 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.412 ' O ' HG23 ' A' ' 61' ' ' ILE . 10.8 mp -61.89 -40.63 96.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.351 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.458 ' O ' HG12 ' A' ' 61' ' ' ILE . 13.3 t80 -66.88 -44.17 81.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.993 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.11 -45.33 91.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.383 0.611 . . . . 0.0 110.064 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -58.79 -40.26 83.52 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.595 -178.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.515 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 23.4 pt -75.55 -30.11 21.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.551 -176.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -83.79 -22.76 31.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.785 0.326 . . . . 0.0 111.081 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -105.21 145.01 31.2 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -172.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.59 ' HB3' ' HG3' ' A' ' 85' ' ' PRO . 25.6 t 53.33 34.72 18.53 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 160.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.515 ' HE2' ' HA ' ' A' ' 61' ' ' ILE . 52.8 mmtt -63.02 -26.07 68.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.918 -0.489 . . . . 0.0 111.347 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -131.59 -166.95 1.79 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.042 0.448 . . . . 0.0 110.328 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.8 p -158.13 161.42 37.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.9 p -62.81 -26.68 68.86 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.221 0.534 . . . . 0.0 112.398 -171.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.446 ' CE2' ' HA ' ' A' ' 104' ' ' LYS . 1.2 t80 -69.0 -16.66 63.78 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.753 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.445 ' HB3' HG21 ' A' ' 103' ' ' VAL . 25.8 p -124.8 5.71 8.1 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.81 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 m -137.16 152.72 50.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 179.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -82.03 -20.03 39.19 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.49 105.39 0.52 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.016 173.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -80.09 -13.39 59.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.223 0.535 . . . . 0.0 110.776 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -87.1 74.61 9.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.471 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 36.2 m -86.47 139.29 31.03 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.672 -176.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -92.26 37.7 0.99 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 171.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -115.26 138.2 51.2 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.176 -172.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.4 mp -80.14 -68.57 0.66 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.423 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.413 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 7.4 mp -85.49 100.83 12.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.876 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -63.68 139.5 58.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.125 0.488 . . . . 0.0 110.698 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.87 -8.69 79.0 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.454 -176.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -121.96 168.87 11.4 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 122.248 0.219 . . . . 0.0 110.516 -179.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -131.97 153.72 81.48 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.59 ' HG3' ' HB3' ' A' ' 64' ' ' SER . 93.9 Cg_endo -79.0 151.15 23.8 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.638 2.226 . . . . 0.0 112.085 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -147.85 137.36 22.44 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.645 176.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.9 mt -68.4 131.76 45.87 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.326 178.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 18.7 m -135.8 149.92 28.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.798 178.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.9 p -104.33 116.75 48.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.386 0.612 . . . . 0.0 110.765 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -112.91 99.0 7.54 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.445 176.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.75 -118.36 6.07 Favored Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.432 -175.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.469 ' HA ' ' HE1' ' A' ' 49' ' ' MET . 34.8 mmt180 -111.12 14.17 21.85 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.922 0.392 . . . . 0.0 110.663 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.6 p -122.26 141.9 51.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.677 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 84.1 mt -97.53 130.21 46.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.962 0.411 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -118.12 175.3 5.75 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.427 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 58.1 mt -128.14 98.06 4.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.787 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -103.91 -175.86 2.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.718 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.413 ' CD2' ' HB2' ' A' ' 80' ' ' LEU . 9.1 m-85 -123.8 138.48 54.5 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -171.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -115.06 157.45 23.5 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 170.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -73.69 142.71 46.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.808 0.337 . . . . 0.0 111.613 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.7 t -60.55 122.77 70.27 Favored Pre-proline 0 C--N 1.333 -0.135 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.563 177.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -58.72 -17.03 33.76 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.995 2.463 . . . . 0.0 112.761 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.445 HG21 ' HB3' ' A' ' 70' ' ' CYS . 93.0 t -66.49 -16.85 21.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.953 175.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.446 ' HA ' ' CE2' ' A' ' 69' ' ' TYR . 36.7 ttpt -68.08 -16.84 64.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.313 0.578 . . . . 0.0 109.829 177.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 9.0 tpm_? -94.18 88.82 5.74 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.469 174.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm . . . . . 0 C--N 1.322 -0.587 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.97 179.485 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 tpt . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 121.232 0.539 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.417 ' HA ' ' HD2' ' A' ' 3' ' ' PRO . 3.3 mp0 -116.29 88.3 22.69 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.446 -174.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 2' ' ' GLU . 18.1 Cg_endo -58.73 141.83 98.13 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.714 2.276 . . . . 0.0 112.048 -178.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 62.1 mt -95.15 94.4 4.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -167.9 35.1 0.21 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.972 -177.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -81.57 95.45 7.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.521 0.677 . . . . 0.0 110.058 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 35.8 t -94.42 120.82 35.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.038 -177.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -68.39 -62.34 1.44 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.219 0.533 . . . . 0.0 110.436 -179.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -140.55 21.34 2.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.562 0.696 . . . . 0.0 109.628 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.15 -159.07 13.95 Favored Glycine 0 N--CA 1.441 -1.019 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 -170.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.6 m -95.32 100.48 11.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 121.648 0.737 . . . . 0.0 110.768 178.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.5 m -68.21 -20.26 64.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.178 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 148.87 174.6 20.63 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.724 177.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.431 ' HA ' ' HD2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -146.29 85.52 7.37 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.393 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.629 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 10.4 Cg_endo -53.45 139.75 64.89 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.315 2.677 . . . . 0.0 112.068 179.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.606 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 1.2 m-20 -63.8 -17.97 63.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.536 -178.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -59.83 -52.8 63.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 173.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.629 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -71.13 -33.24 69.91 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.339 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.606 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 45.1 mtpt -58.71 -44.23 90.31 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.218 176.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.45 ' O ' ' HG2' ' A' ' 24' ' ' MET . 18.0 tpp85 -69.45 -51.36 36.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.704 177.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.7 tp -58.07 -49.86 75.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.467 -175.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -76.94 -27.3 54.78 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 8.7 tt0 -63.12 -55.57 24.21 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 120.923 0.392 . . . . 0.0 110.077 175.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.62 ' O ' HG22 ' A' ' 28' ' ' VAL . 25.9 ptm -61.84 -34.02 75.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.158 177.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.445 ' HE3' ' HB2' ' A' ' 25' ' ' LYS . 3.7 tppp? -55.29 -55.62 29.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.101 174.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.563 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 39.4 tt0 -62.68 -40.39 96.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.651 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 27' ' ' LYS . 5.2 mmmm -52.39 -39.82 61.32 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.467 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.706 HG13 HG13 ' A' ' 34' ' ' VAL . 68.0 t -70.27 -39.01 76.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.11 -178.394 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 65.7 mtt -73.9 -4.81 37.32 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.532 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.563 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 27.3 mmtp -98.81 -5.82 30.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.738 0.304 . . . . 0.0 111.506 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -84.81 141.34 30.55 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.111 0.481 . . . . 0.0 111.201 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -69.94 -39.93 75.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.899 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -77.49 -42.15 36.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.902 0.382 . . . . 0.0 109.997 -174.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.706 HG13 HG13 ' A' ' 28' ' ' VAL . 40.0 t -54.57 -55.49 14.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.214 177.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.44 -32.56 74.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.755 0.312 . . . . 0.0 111.217 -177.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.69 -40.12 92.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.003 174.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -65.77 -40.45 92.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.608 176.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.812 HD12 HD11 ' A' ' 50' ' ' ILE . 2.0 mm? -57.54 -45.61 84.89 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.468 178.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -79.77 -20.46 46.22 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.926 0.394 . . . . 0.0 110.804 -178.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -68.4 -52.33 34.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.551 0.691 . . . . 0.0 109.966 176.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -106.86 29.97 6.55 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.329 -177.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -64.68 -16.08 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.283 0.563 . . . . 0.0 110.676 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.12 -19.89 59.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.579 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 39.8 t -119.37 -37.37 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.542 -173.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.8 mt -73.52 140.14 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.322 0.582 . . . . 0.0 111.919 -174.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.79 165.28 11.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.21 176.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -67.89 -36.99 81.2 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 172.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -57.69 -43.66 85.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.227 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.537 ' HE3' ' HA ' ' A' ' 92' ' ' ARG . 46.6 ttm -59.78 -37.17 78.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.851 178.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.812 HD11 HD12 ' A' ' 38' ' ' LEU . 38.6 mm -63.25 -54.89 27.25 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.174 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.8 mm-40 -50.83 -46.93 60.2 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 122.978 0.511 . . . . 0.0 111.459 176.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -68.74 -38.94 80.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.991 -177.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.411 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 5.6 m -101.67 17.38 23.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.342 0.592 . . . . 0.0 110.337 -176.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.406 HD21 HG22 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -65.36 -43.81 89.64 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.343 -174.658 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -57.54 -34.48 69.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.715 175.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.41 ' O ' HD11 ' A' ' 96' ' ' ILE . 66.5 mmtt -67.27 -53.65 28.01 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.903 0.382 . . . . 0.0 110.807 178.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.435 HD13 HG21 ' A' ' 94' ' ' ILE . 10.9 mp -62.72 -39.68 94.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.465 -177.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.41 ' O ' ' HG2' ' A' ' 62' ' ' GLU . 48.2 t80 -67.5 -41.24 84.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.986 0.422 . . . . 0.0 110.383 178.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 23.5 tt0 -62.54 -41.18 98.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.978 178.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -56.03 -52.81 62.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.832 178.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.6 pt -69.39 -29.86 43.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -174.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 58' ' ' TYR . 60.9 mm-40 -79.17 -17.04 55.69 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.923 0.392 . . . . 0.0 110.927 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 22.7 mt-30 -82.42 -175.3 5.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.423 0.63 . . . . 0.0 111.904 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.1 p -74.42 114.7 13.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.016 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -73.78 -27.53 61.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.912 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.482 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.0 t-20 -115.24 -170.64 1.8 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.03 -170.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.428 ' SG ' ' HB3' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -134.23 143.69 47.97 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.735 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 11.9 t -71.93 -11.5 60.82 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.256 -169.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.428 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 34.4 t80 -63.51 -31.75 73.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.917 175.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.482 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 32.1 p -114.64 -20.17 10.8 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.582 -0.447 . . . . 0.0 112.072 -173.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.5 p -113.42 142.85 45.4 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -112.51 24.55 12.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.525 0.678 . . . . 0.0 110.028 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.14 139.81 46.65 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.963 175.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -62.59 -24.03 67.34 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.937 -178.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -102.31 -1.39 31.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.669 -174.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 17.5 p -93.26 19.8 7.74 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.68 -174.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -71.84 96.35 1.64 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.425 0.631 . . . . 0.0 110.189 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.422 ' OD1' HD21 ' A' ' 79' ' ' LEU . 44.9 t-20 -87.14 141.95 28.27 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.335 -179.188 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.422 HD21 ' OD1' ' A' ' 78' ' ' ASN . 2.3 pt? -61.59 -40.56 95.21 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.055 0.455 . . . . 0.0 110.031 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 24.3 mt -86.32 158.36 19.68 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 172.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -140.48 131.16 25.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.483 0.658 . . . . 0.0 110.742 -170.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 80.69 6.08 89.58 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.893 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.419 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 77.2 m-85 -132.51 156.45 46.77 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 122.261 0.224 . . . . 0.0 110.533 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -126.95 150.6 72.29 Favored Pre-proline 0 N--CA 1.466 0.347 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 175.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.55 149.89 27.54 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 122.552 2.168 . . . . 0.0 112.408 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.1 pttt -147.34 160.1 42.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.118 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -87.2 138.54 31.4 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.527 HG13 ' OE1' ' A' ' 97' ' ' GLU . 18.1 m -133.5 150.39 32.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.554 178.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 p -102.46 120.7 52.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.47 0.652 . . . . 0.0 110.789 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -122.54 99.94 6.67 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.732 176.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.66 -111.64 4.21 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.548 -176.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.537 ' HA ' ' HE3' ' A' ' 49' ' ' MET . 6.3 mpt_? -114.4 15.82 17.89 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.187 0.518 . . . . 0.0 109.884 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.1 p -125.89 138.65 53.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.762 -178.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.435 HG21 HD13 ' A' ' 57' ' ' LEU . 67.4 mt -98.3 132.88 42.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 178.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -124.89 178.92 5.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -176.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.41 HD11 ' O ' ' A' ' 56' ' ' LYS . 50.2 mt -124.51 108.78 21.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.866 0.365 . . . . 0.0 110.59 -176.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.527 ' OE1' HG13 ' A' ' 88' ' ' VAL . 51.5 mt-10 -106.87 -178.14 3.56 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.134 177.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.419 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 4.5 m-85 -123.72 132.84 53.91 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.739 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -110.01 154.5 23.09 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -72.77 136.95 45.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.29 0.566 . . . . 0.0 110.848 -175.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.404 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 49.2 t -59.29 126.1 80.92 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.051 178.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 9.4 Cg_endo -55.7 -24.0 43.75 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.795 2.33 . . . . 0.0 111.984 176.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.695 ' HA ' ' HG2' ' A' ' 106' ' ' LYS . 25.0 t -81.44 -14.27 12.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.176 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -68.59 -15.68 63.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.535 -173.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 65.1 mtt180 -133.2 33.52 3.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.695 ' HG2' ' HA ' ' A' ' 103' ' ' VAL . 33.8 mmtp . . . . . 0 C--O 1.235 0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.4 175.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.483 1.199 0 CA-C-O 120.942 0.401 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.6 OUTLIER -108.59 145.51 31.75 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.237 -179.526 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 2' ' ' GLU . 5.5 Cg_exo -78.93 87.57 1.54 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.871 2.381 . . . . 0.0 112.487 -178.1 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 68.7 mt -74.16 -44.06 50.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.221 0.534 . . . . 0.0 110.458 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 113.35 125.17 4.27 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.348 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.76 -9.72 11.21 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.167 0.508 . . . . 0.0 110.409 178.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -129.16 88.94 2.78 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.935 177.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.5 mp -90.4 -60.52 1.9 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.069 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -149.27 132.9 16.8 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.931 178.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -101.12 107.54 3.27 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.536 177.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.6 m -78.62 133.74 29.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.198 0.523 . . . . 0.0 111.311 -177.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.0 p -94.23 2.24 55.92 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.814 175.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.448 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . 130.23 -154.02 20.39 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.088 -178.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.448 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 1.7 mpp_? -142.41 80.12 14.96 Favored Pre-proline 0 C--N 1.324 -0.514 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.425 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 26.7 Cg_endo -63.86 107.37 0.75 Allowed 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.861 2.374 . . . . 0.0 112.089 176.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -69.46 -23.83 63.71 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.162 -176.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -65.58 -48.42 72.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.693 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.425 ' HG2' ' HG2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -69.42 -31.67 70.16 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -179.161 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 52.1 mtpt -60.43 -50.11 74.88 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.987 175.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -63.95 -45.96 86.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.247 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.7 tp -58.06 -50.14 74.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.664 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -75.71 -26.97 58.02 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.4 tp-100 -57.98 -57.06 14.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.108 0.48 . . . . 0.0 109.713 174.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.634 ' HE3' ' HG ' ' A' ' 54' ' ' LEU . 25.8 ptm -65.65 -36.08 82.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.522 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -54.01 -52.54 60.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.564 175.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 30' ' ' LYS . 38.2 tt0 -66.8 -43.56 83.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.866 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.3 mtpt -56.09 -41.86 75.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.639 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.439 HG22 ' O ' ' A' ' 24' ' ' MET . 73.7 t -64.44 -44.07 97.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.693 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.438 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 23.6 ptp -82.03 2.1 32.6 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.195 0.521 . . . . 0.0 110.765 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 13.9 tptt -94.74 -29.24 14.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.048 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -66.27 143.95 56.9 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.398 0.618 . . . . 0.0 111.538 -174.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -69.11 -47.14 65.93 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.444 -175.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -71.45 -42.8 67.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.798 -177.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.481 HG23 HD12 ' A' ' 87' ' ' LEU . 51.0 t -56.48 -54.6 26.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.758 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -65.92 -30.71 71.33 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.383 -176.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.536 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . . . -62.52 -44.31 96.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.127 174.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.423 ' CE2' HD11 ' A' ' 45' ' ' ILE . 60.1 t80 -64.13 -39.62 94.42 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.676 177.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.582 HD13 HD12 ' A' ' 50' ' ' ILE . 2.6 mm? -58.37 -51.78 68.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.636 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.536 ' HE3' ' HA ' ' A' ' 36' ' ' ALA . 23.4 pttp -67.42 -28.16 67.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.023 0.439 . . . . 0.0 110.764 -177.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.81 -28.29 62.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.735 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -122.92 26.81 7.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.707 -174.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -66.52 -15.99 63.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.204 0.526 . . . . 0.0 110.968 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -70.9 -34.83 71.94 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.187 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 19.2 t -102.63 -39.56 6.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.366 -172.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 37' ' ' PHE . 63.9 mt -75.96 138.46 20.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.069 -175.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.447 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -131.44 -177.72 4.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.905 -178.311 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -57.93 -41.47 82.8 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.758 0.313 . . . . 0.0 111.487 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -71.05 -42.04 69.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.58 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 45.9 tpp -56.26 -36.2 68.3 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.778 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.582 HD12 HD13 ' A' ' 38' ' ' LEU . 41.4 mm -63.94 -49.27 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.896 177.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -68.65 -37.85 79.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.853 -178.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -58.94 -48.47 81.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.158 0.504 . . . . 0.0 110.863 176.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.634 ' OG ' ' HB ' ' A' ' 94' ' ' ILE . 33.6 t -98.8 17.03 20.41 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.769 -173.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.634 ' HG ' ' HE3' ' A' ' 24' ' ' MET . 41.4 tp -60.16 -38.15 82.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.794 0.33 . . . . 0.0 110.457 -178.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -74.17 -35.7 64.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.204 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -66.63 -47.01 73.93 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.856 0.36 . . . . 0.0 110.811 177.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 53' ' ' SER . 95.1 mt -66.2 -39.07 89.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.632 -178.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -71.61 -37.89 70.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.241 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.66 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 31.2 tt0 -64.29 -36.81 85.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.186 0.517 . . . . 0.0 109.806 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.513 ' CE1' ' HB2' ' A' ' 85' ' ' PRO . 79.8 t80 -56.46 -51.15 69.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.184 176.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -74.9 -29.7 22.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -174.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.66 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 7.5 pt-20 -80.14 -13.07 59.55 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.167 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.537 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 45.6 mt-30 -85.63 -177.58 6.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.022 0.439 . . . . 0.0 110.54 174.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.1 t -87.47 105.15 17.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.311 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -69.4 -26.34 64.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.418 . . . . 0.0 109.991 175.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -83.0 -178.27 7.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.881 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 p -147.41 154.7 41.18 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.488 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 3.0 p -55.24 -33.48 63.16 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 124.239 0.962 . . . . 0.0 112.334 -174.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -62.54 -9.89 10.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.722 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.2 p -140.17 -0.79 1.61 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.449 ' OG ' ' HA ' ' A' ' 68' ' ' SER . 27.0 p -105.79 107.23 18.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.385 0.612 . . . . 0.0 111.307 -176.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -86.28 67.87 10.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.745 1.26 . . . . 0.0 109.255 176.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -153.79 156.97 38.69 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 113.006 -1.906 . . . . 0.0 108.435 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.64 -20.36 65.62 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 123.432 0.458 . . . . 0.0 111.563 -178.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -69.65 80.6 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.66 0.743 . . . . 0.0 111.2 177.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 68' ' ' SER . 48.3 t -108.11 23.54 14.34 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.073 176.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -83.44 25.02 0.78 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.982 -174.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -80.14 139.35 36.86 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 174.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.423 ' HB3' HD11 ' A' ' 80' ' ' LEU . 3.0 tt -69.72 -65.19 0.75 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.961 0.41 . . . . 0.0 110.091 -177.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.423 HD11 ' HB3' ' A' ' 79' ' ' LEU . 6.6 mp -85.64 122.14 29.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.94 0.4 . . . . 0.0 109.96 177.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -94.82 139.66 30.98 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.091 0.472 . . . . 0.0 110.196 178.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.35 -7.71 81.42 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.733 -178.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -121.27 164.2 17.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.456 0.169 . . . . 0.0 110.627 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.441 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 16.0 m170 -128.51 145.12 54.69 Favored Pre-proline 0 CA--C 1.515 -0.4 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.853 173.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.513 ' HB2' ' CE1' ' A' ' 60' ' ' TYR . 20.4 Cg_exo -64.0 135.55 48.23 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.516 2.144 . . . . 0.0 111.823 174.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.604 ' HG3' ' HB3' ' A' ' 97' ' ' GLU . 17.3 ptmt -134.21 146.74 50.4 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.175 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.481 HD12 HG23 ' A' ' 34' ' ' VAL . 98.1 mt -86.92 135.4 33.32 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 120.791 0.329 . . . . 0.0 110.705 -179.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 15.5 m -134.35 139.77 47.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.409 177.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.5 p -77.95 122.44 32.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 173.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -123.14 95.45 4.61 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.959 -171.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.446 ' C ' ' HD2' ' A' ' 92' ' ' ARG . . . 61.6 -106.97 1.31 Allowed Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.466 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.508 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 2.4 mpt_? -111.86 19.63 17.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.03 0.443 . . . . 0.0 110.958 -178.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 13.3 t -145.41 178.68 7.93 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.634 ' HB ' ' OG ' ' A' ' 53' ' ' SER . 75.5 mt -116.33 137.33 50.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 174.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -130.51 177.07 7.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.156 0.503 . . . . 0.0 110.953 -173.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 61.7 mt -118.8 122.62 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.852 -176.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.604 ' HB3' ' HG3' ' A' ' 86' ' ' LYS . 14.4 tt0 -107.74 -176.76 3.15 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.425 178.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.441 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 9.6 m-85 -137.45 134.76 36.19 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 110.529 -0.174 . . . . 0.0 110.529 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.447 ' CD2' ' HB3' ' A' ' 86' ' ' LYS . 53.4 p90 -117.61 160.83 20.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.215 176.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -72.55 126.03 28.87 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.379 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.4 t -51.01 123.04 18.36 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.523 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -56.96 -18.7 29.12 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.306 2.671 . . . . 0.0 113.15 178.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.3 t -74.83 -13.01 15.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.148 0.499 . . . . 0.0 110.769 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.456 ' O ' ' HG2' ' A' ' 105' ' ' ARG . 53.3 mmtt -56.89 -51.21 69.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.819 173.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 12.8 ptm180 45.86 28.72 0.62 Allowed 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.427 1.079 . . . . 0.0 112.814 177.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 104' ' ' LYS . 56.1 mttp . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.221 -178.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.9 ptm . . . . . 0 N--CA 1.483 1.189 0 CA-C-O 120.766 0.317 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -112.86 87.49 10.26 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.94 -176.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -67.38 116.23 4.1 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 122.032 1.821 . . . . 0.0 111.52 177.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.406 ' O ' ' HD3' ' A' ' 6' ' ' ARG . 45.1 mm -67.81 -36.25 75.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.325 0.583 . . . . 0.0 110.123 -178.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.93 -65.01 4.19 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.434 175.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.522 ' HD3' ' H ' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -88.91 79.29 7.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.803 0.811 . . . . 0.0 111.123 -177.001 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.7 m -76.12 92.89 3.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.581 174.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.4 mt -79.64 79.96 6.08 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.803 -174.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -77.11 91.16 3.67 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 165.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.47 84.5 1.81 Allowed Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -168.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.3 m -78.93 0.68 2.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -171.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.0 p -73.84 -10.77 60.0 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.794 -178.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.476 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -137.46 148.44 19.82 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.279 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.476 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.3 OUTLIER -143.26 83.01 11.3 Favored Pre-proline 0 C--N 1.329 -0.289 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.296 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.522 ' HB2' ' HG2' ' A' ' 18' ' ' GLN . 23.6 Cg_endo -62.73 91.39 0.13 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.953 2.436 . . . . 0.0 112.919 177.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.506 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 30.9 t70 -77.27 -28.18 53.37 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.051 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.13 -49.83 72.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.909 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.522 ' HG2' ' HB2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -67.92 -30.42 69.74 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 121.166 -0.214 . . . . 0.0 110.587 -178.844 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.506 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 48.8 mtmt -63.51 -50.11 70.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.96 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -72.54 -28.05 62.6 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.769 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 35.3 tp -67.62 -49.98 60.34 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.858 0.361 . . . . 0.0 110.802 178.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -64.93 -32.66 74.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.419 176.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -62.33 -57.38 11.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.409 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.428 ' O ' HG22 ' A' ' 28' ' ' VAL . 26.7 ptm -63.51 -39.04 93.38 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.792 -179.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.583 ' O ' ' HG2' ' A' ' 29' ' ' MET . 19.3 tptp -60.22 -48.85 79.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.457 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -54.08 -50.35 66.99 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.316 176.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.597 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 62.8 mtpt -54.86 -48.35 73.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.615 -176.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.537 ' HA ' HD11 ' A' ' 61' ' ' ILE . 91.3 t -64.63 -46.18 93.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.078 0.466 . . . . 0.0 111.112 -176.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.583 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.2 ptt? -88.08 5.99 38.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.442 0.639 . . . . 0.0 110.463 -171.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.645 ' HD2' ' N ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -102.81 -34.71 8.9 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.087 -0.961 . . . . 0.0 109.875 175.159 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.645 ' N ' ' HD2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -59.42 132.02 52.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.314 -172.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -62.9 -41.93 99.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.939 -172.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -60.1 -39.08 84.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.421 0.629 . . . . 0.0 110.207 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 97.5 t -65.27 -37.93 81.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.663 -179.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 70.9 mm-40 -58.76 -54.09 51.05 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.183 0.516 . . . . 0.0 110.766 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.24 -35.11 76.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.24 -176.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.508 ' CZ ' HG21 ' A' ' 89' ' ' VAL . 82.0 t80 -71.35 -42.4 68.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.714 178.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.704 HD12 HD11 ' A' ' 50' ' ' ILE . 1.1 mm? -59.31 -43.35 92.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.585 -179.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -79.14 -25.33 42.9 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.607 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -65.41 -54.75 24.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.304 0.573 . . . . 0.0 110.402 177.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -103.01 30.0 5.1 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.359 -174.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -60.46 -32.47 71.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -175.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -69.88 -28.99 66.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.238 0.542 . . . . 0.0 110.478 -177.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.2 t -97.54 -43.86 12.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.605 -176.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.722 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 66.2 mt -72.36 142.56 15.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.534 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -120.5 164.35 16.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.853 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -54.56 -45.0 73.4 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.305 0.574 . . . . 0.0 110.558 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -66.99 -35.83 80.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.616 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.722 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 23.0 ttt -59.91 -36.59 77.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.402 177.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.704 HD11 HD12 ' A' ' 38' ' ' LEU . 44.0 mm -62.74 -50.94 77.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.537 177.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.84 -39.31 93.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.634 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -60.95 -42.81 98.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.175 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.436 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.7 m -107.62 22.98 15.16 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.976 -175.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 25.6 tp -64.9 -26.33 68.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.01 0.433 . . . . 0.0 109.872 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -67.86 -41.23 83.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.166 176.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -67.71 -50.59 56.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.257 176.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 53' ' ' SER . 83.1 mt -58.19 -40.19 80.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.022 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -71.9 -45.88 59.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.29 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.543 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 40.7 tt0 -62.4 -34.79 77.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.369 0.604 . . . . 0.0 110.163 178.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -56.99 -53.27 59.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.295 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.537 HD11 ' HA ' ' A' ' 28' ' ' VAL . 41.9 pt -73.81 -30.6 28.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -174.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.543 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 8.7 pt-20 -78.74 -19.75 51.58 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 120.939 -0.305 . . . . 0.0 111.53 -177.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -73.2 -177.93 2.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.118 0.485 . . . . 0.0 110.964 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.551 ' HB2' ' HB2' ' A' ' 77' ' ' ASN . 13.7 t -71.42 114.17 9.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.217 -177.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -64.59 -44.66 89.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.004 -179.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.413 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 2.3 m-20 -98.47 -163.45 1.04 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.916 177.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 4.9 p -148.58 157.09 43.22 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.431 ' OG ' ' HB3' ' A' ' 76' ' ' CYS . 2.6 m -62.23 -24.04 67.01 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.324 0.583 . . . . 0.0 111.188 -171.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -62.43 -20.06 64.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.255 177.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.3 p -128.07 -25.54 3.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -176.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.1 p -106.12 -171.91 1.99 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.732 0.301 . . . . 0.0 111.47 -175.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -107.63 17.36 22.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.432 -175.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -69.02 121.46 16.71 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.39 -40.15 27.04 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.043 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -101.97 85.18 2.64 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.102 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.431 ' HB3' ' OG ' ' A' ' 68' ' ' SER . 19.0 p -47.93 114.35 0.9 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.588 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . 0.551 ' HB2' ' HB2' ' A' ' 64' ' ' SER . 75.2 m-20 -87.35 -6.79 58.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.936 175.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -82.06 116.55 21.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.604 176.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.5 tp -61.09 -55.19 35.5 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.5 mp -86.93 87.72 7.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.566 172.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -72.06 148.97 45.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.023 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.54 -9.06 75.07 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 -171.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.439 ' CB ' ' HD2' ' A' ' 98' ' ' TYR . 74.9 m-85 -123.13 168.05 12.89 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.413 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 17.5 m170 -127.95 150.97 75.02 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 172.062 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -74.35 142.5 30.15 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 122.09 1.86 . . . . 0.0 111.391 174.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.507 ' HB3' ' CE1' ' A' ' 99' ' ' TYR . 25.2 pttm -140.31 153.46 46.46 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.9 mt -84.92 142.82 29.4 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.624 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.1 m -136.2 148.63 27.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.077 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.719 HG12 ' HE1' ' A' ' 49' ' ' MET . 4.5 t -103.64 114.12 42.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.355 0.598 . . . . 0.0 110.263 176.092 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -114.43 96.17 5.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.647 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.82 -112.28 3.88 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.585 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.47 ' C ' ' HE2' ' A' ' 49' ' ' MET . 24.5 mmt180 -117.46 16.09 14.69 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.143 0.497 . . . . 0.0 110.278 176.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 15.3 m -124.18 136.95 54.55 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.147 177.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.455 HG12 HG22 ' A' ' 89' ' ' VAL . 58.2 mt -94.51 135.18 29.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.56 178.61 6.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.077 0.465 . . . . 0.0 110.799 -173.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 69.3 mt -118.94 130.26 74.01 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.291 -176.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.06 176.38 7.06 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.352 -177.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.439 ' HD2' ' CB ' ' A' ' 83' ' ' TYR . 5.0 m-85 -128.71 149.94 50.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.767 0.318 . . . . 0.0 110.736 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.507 ' CE1' ' HB3' ' A' ' 86' ' ' LYS . 51.3 p90 -139.95 152.54 46.42 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.418 ' HG3' ' CE2' ' A' ' 83' ' ' TYR . 2.5 mp0 -61.27 134.2 56.71 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.982 0.42 . . . . 0.0 111.236 -178.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.6 t -53.38 123.21 35.02 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.448 175.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.77 -25.52 79.48 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.829 2.352 . . . . 0.0 112.176 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 50.8 t -67.81 -19.95 25.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.871 179.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -76.77 -18.12 58.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.391 0.615 . . . . 0.0 109.882 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -103.35 97.57 7.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.866 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 66.3 mttm . . . . . 0 C--N 1.322 -0.6 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.809 -177.53 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 120.998 0.428 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.446 ' HA ' ' HD2' ' A' ' 3' ' ' PRO . 44.7 mt-10 -115.24 88.22 17.79 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.945 174.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 2' ' ' GLU . 6.6 Cg_endo -47.77 115.79 1.61 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.267 2.644 . . . . 0.0 112.264 -177.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.3 mm -88.23 103.92 14.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.199 0.523 . . . . 0.0 111.182 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -143.76 -168.79 12.43 Favored Glycine 0 N--CA 1.447 -0.612 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 176.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -151.08 135.73 17.15 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 117.857 0.829 . . . . 0.0 111.146 177.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 19.8 m -79.82 101.63 8.62 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.573 175.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 89.3 mt -44.11 -62.56 1.1 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.936 0.773 . . . . 0.0 112.778 -173.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -104.31 -3.79 23.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.911 0.386 . . . . 0.0 111.323 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -101.59 56.71 0.69 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.552 -176.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.8 t -101.13 -47.66 11.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.04 0.448 . . . . 0.0 110.45 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.0 t -60.59 -27.51 67.78 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.484 -178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.414 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -159.74 151.39 22.12 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.986 -0.626 . . . . 0.0 111.671 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.414 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.5 OUTLIER -143.2 73.83 17.77 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -77.54 161.3 31.3 Favored 'Trans proline' 0 N--CA 1.464 -0.234 0 C-N-CA 122.712 2.275 . . . . 0.0 112.039 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.618 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 2.4 p-10 -68.38 -27.25 66.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 177.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -49.6 -49.58 46.2 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.457 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.09 -33.26 75.37 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.681 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 26.0 mmtp -73.55 -29.44 62.44 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.618 ' HG2' ' O ' ' A' ' 16' ' ' ASP . 13.7 mmm-85 -68.37 -46.47 69.99 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 172.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.7 tp -55.57 -48.88 74.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.116 177.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -65.56 -39.14 91.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.017 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.507 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.9 tp-100 -63.76 -52.1 61.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.764 -177.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.549 ' HE3' HD23 ' A' ' 54' ' ' LEU . 25.8 ptm -66.63 -38.28 86.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.48 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.509 ' HG3' ' HE2' ' A' ' 29' ' ' MET . 49.1 tptt -59.46 -44.22 93.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.178 0.513 . . . . 0.0 109.931 177.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.448 ' HA ' ' HG2' ' A' ' 29' ' ' MET . 33.1 tt0 -67.07 -44.41 80.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.318 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -52.29 -51.01 61.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.215 177.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.468 HG21 ' O ' ' A' ' 24' ' ' MET . 85.5 t -59.06 -41.82 84.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.944 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.509 ' HE2' ' HG3' ' A' ' 25' ' ' LYS . 21.7 ptp -85.52 14.91 4.99 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -176.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -119.45 -2.33 10.58 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 176.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.675 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 29.6 t70 -85.3 135.11 34.05 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.617 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.516 ' HG3' ' N ' ' A' ' 33' ' ' ASP . 5.1 pt20 -63.34 -41.16 98.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.073 -176.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.516 ' N ' ' HG3' ' A' ' 32' ' ' GLN . 11.9 m-20 -74.12 -33.1 63.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.022 0.439 . . . . 0.0 110.001 -175.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.13 -43.9 93.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.047 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.675 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 71.2 mm-40 -56.44 -50.32 72.02 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.269 0.557 . . . . 0.0 110.496 177.614 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.483 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -56.9 -45.66 82.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.424 -178.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -67.34 -41.35 85.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.136 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.462 HD12 HD12 ' A' ' 50' ' ' ILE . 1.9 mm? -57.82 -43.83 86.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.449 -178.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.538 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.6 ptmm? -82.8 -22.04 34.33 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.753 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 1.1 tm-20 -65.92 -39.56 90.66 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -116.81 32.48 6.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.843 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.538 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 10.7 pt-20 -61.43 -22.5 65.08 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.073 0.463 . . . . 0.0 111.181 -178.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -77.62 -34.63 53.29 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 177.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.3 t -93.29 -39.36 10.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.394 -171.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.529 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 76.1 mt -71.61 142.97 14.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.24 0.543 . . . . 0.0 111.434 -174.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -120.81 166.02 14.34 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.031 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.412 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 57.4 mt-30 -57.69 -44.17 85.63 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.241 0.543 . . . . 0.0 109.963 174.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -63.71 -38.33 90.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.029 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.529 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 50.7 ttm -57.01 -39.16 74.19 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.255 177.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.462 HD12 HD12 ' A' ' 38' ' ' LEU . 45.7 mm -67.27 -42.06 87.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.879 178.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 42.7 mm-40 -66.88 -43.28 83.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.129 0.49 . . . . 0.0 110.417 -178.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -67.57 -30.24 69.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.3 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.486 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.5 m -109.0 19.1 19.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.262 -175.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.549 HD23 ' HE3' ' A' ' 24' ' ' MET . 1.2 mt -59.76 -46.6 88.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.053 0.454 . . . . 0.0 110.427 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -57.73 -39.84 78.24 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.856 176.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.567 ' O ' HD12 ' A' ' 96' ' ' ILE . 4.9 mmpt? -67.66 -51.05 54.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.139 0.495 . . . . 0.0 110.283 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 53' ' ' SER . 90.3 mt -62.24 -41.65 98.61 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.127 -177.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -69.49 -43.97 72.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.414 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.56 ' HG3' ' NE2' ' A' ' 63' ' ' GLN . 11.1 tp10 -56.44 -39.38 73.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.135 0.493 . . . . 0.0 109.892 175.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.433 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 56.2 t80 -56.52 -52.61 64.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.917 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.516 ' HA ' ' HD3' ' A' ' 65' ' ' LYS . 32.9 pt -75.53 -30.57 22.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -77.61 -19.62 55.25 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 111.283 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.56 ' NE2' ' HG3' ' A' ' 59' ' ' GLU . 46.0 mt-30 -78.79 -171.54 2.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.163 0.506 . . . . 0.0 110.756 175.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.2 p -75.64 99.74 4.41 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.423 178.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.516 ' HD3' ' HA ' ' A' ' 61' ' ' ILE . 12.3 mmmm -63.78 -26.49 68.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.206 0.527 . . . . 0.0 110.265 176.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.539 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.5 t-20 -112.63 -165.65 1.01 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.568 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -148.09 154.53 40.33 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.902 178.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.644 ' HA ' ' O ' ' A' ' 71' ' ' SER . 25.6 t -67.78 -20.62 65.22 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.236 -175.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -69.44 -13.67 62.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 111.601 -179.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.539 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 24.6 p -123.33 -33.69 3.22 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.696 -0.401 . . . . 0.0 110.534 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.644 ' O ' ' HA ' ' A' ' 68' ' ' SER . 39.5 m -125.29 103.79 8.13 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -85.66 61.24 6.73 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.904 0.859 . . . . 0.0 110.614 -173.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -85.37 139.42 31.58 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.511 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -86.54 -21.76 26.73 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.656 -174.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -90.28 -34.02 15.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.694 0.283 . . . . 0.0 111.228 -174.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.67 120.41 11.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.109 0.481 . . . . 0.0 111.496 -178.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -77.64 92.89 4.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.538 ' OD1' ' HA ' ' A' ' 81' ' ' GLU . 2.4 t-20 -100.43 117.9 35.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.715 178.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.1 mt -74.06 -74.46 0.19 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.466 -176.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.0 mp -85.57 96.78 9.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 174.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.595 ' HG3' ' HB3' ' A' ' 68' ' ' SER . 30.7 tt0 -72.62 124.71 25.82 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.176 0.512 . . . . 0.0 110.173 -177.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 103.88 -7.74 49.45 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.333 -176.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.561 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 15.5 m-85 -121.37 162.01 21.12 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 178.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.0 m170 -124.68 150.88 66.69 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 173.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.425 ' HB2' ' CD1' ' A' ' 60' ' ' TYR . 55.5 Cg_endo -71.39 141.44 38.81 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.672 2.248 . . . . 0.0 111.536 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.596 ' HB2' ' CD1' ' A' ' 99' ' ' TYR . 86.4 tttt -131.47 131.14 43.27 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.568 -172.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -85.76 125.98 33.65 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.254 177.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.498 HG11 ' HG3' ' A' ' 97' ' ' GLU . 29.5 m -131.26 145.21 35.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.668 0.271 . . . . 0.0 110.882 178.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.4 p -95.52 120.42 44.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.259 0.552 . . . . 0.0 110.024 176.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -121.96 96.3 5.0 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.866 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.65 -104.31 1.59 Allowed Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.151 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.414 ' HA ' ' HE2' ' A' ' 49' ' ' MET . 5.5 mmp_? -116.57 5.71 13.34 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.565 0.221 . . . . 0.0 111.175 179.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.1 p -130.01 159.86 35.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.975 0.417 . . . . 0.0 111.35 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.9 mt -110.28 137.9 40.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.92 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.486 ' HA ' ' HD3' ' A' ' 56' ' ' LYS . 1.8 t0 -126.97 178.92 5.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.879 0.371 . . . . 0.0 110.63 -175.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.567 HD12 ' O ' ' A' ' 56' ' ' LYS . 44.8 mt -123.1 112.61 34.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.195 -176.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.498 ' HG3' HG11 ' A' ' 88' ' ' VAL . 3.7 mm-40 -98.61 -175.11 2.98 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.272 174.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.561 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 3.3 m-85 -139.67 124.03 18.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 174.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.596 ' CD1' ' HB2' ' A' ' 86' ' ' LYS . 39.0 p90 -110.41 147.02 34.85 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 176.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.454 ' H ' ' CD ' ' A' ' 100' ' ' GLU . 2.3 pm0 -66.44 135.06 53.73 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.478 0.656 . . . . 0.0 110.713 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.437 ' SG ' HG12 ' A' ' 103' ' ' VAL . 21.3 t -44.52 124.67 4.75 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 114.195 -1.366 . . . . 0.0 111.857 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -59.32 -10.23 10.34 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 123.339 2.693 . . . . 0.0 113.435 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.437 HG12 ' SG ' ' A' ' 101' ' ' CYS . 8.7 p -66.57 -18.33 23.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.035 0.445 . . . . 0.0 110.625 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.425 ' HD2' ' HA ' ' A' ' 104' ' ' LYS . 13.1 mmmm -78.16 -24.19 47.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.894 176.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -133.97 75.96 1.63 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.311 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.67 ' HB3' ' HZ3' ' A' ' 106' ' ' LYS . 2.8 mmmp? . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.257 178.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.0 ttm . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.454 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 2.7 mp0 -62.71 145.09 95.95 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.856 -177.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 2' ' ' GLU . 14.5 Cg_exo -68.32 95.04 0.43 Allowed 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.894 2.396 . . . . 0.0 112.874 -177.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.8 tp -116.94 112.5 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.749 172.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -95.21 -50.21 2.09 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.407 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -81.67 89.19 6.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.076 0.465 . . . . 0.0 110.804 -178.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 34.5 p -103.43 169.28 8.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.834 177.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 89.3 mt -106.31 7.63 31.39 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.994 0.426 . . . . 0.0 110.815 -176.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -91.42 23.26 3.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.068 -179.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -133.92 79.72 0.33 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.966 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 63.4 t -62.72 110.12 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.944 0.402 . . . . 0.0 110.47 -179.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.4 p -140.61 176.35 8.85 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.017 -177.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.46 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -77.52 176.04 53.84 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.975 174.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.46 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.2 OUTLIER -141.38 84.11 12.89 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-O 120.9 0.381 . . . . 0.0 110.434 -177.888 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -62.73 124.27 13.81 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.553 2.168 . . . . 0.0 111.62 173.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.428 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 11.4 m-20 -61.51 -29.59 70.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.263 -176.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.81 -51.71 67.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.142 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.66 -31.18 68.01 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.313 -177.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.1 mtpp -66.59 -48.77 68.49 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.966 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.512 ' O ' ' HG2' ' A' ' 24' ' ' MET . 7.2 ptm180 -68.47 -31.69 71.16 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 37.2 tp -62.86 -50.28 71.53 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -59.66 -45.13 92.95 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 120.952 0.406 . . . . 0.0 110.31 176.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -59.1 -57.76 11.62 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.385 -175.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.512 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 25.3 ptm -66.74 -38.3 86.39 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.39 -177.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.533 ' HE2' ' HE3' ' A' ' 29' ' ' MET . 17.0 tptm -64.81 -41.46 95.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.004 0.431 . . . . 0.0 110.292 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.515 ' HG3' ' HD3' ' A' ' 30' ' ' LYS . 23.4 tt0 -61.83 -50.63 71.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.557 177.004 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -54.41 -42.27 70.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.303 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 24' ' ' MET . 87.0 t -68.87 -42.75 82.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.968 0.413 . . . . 0.0 110.953 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.533 ' HE3' ' HE2' ' A' ' 25' ' ' LYS . 44.4 mtt -78.69 -6.93 57.09 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -175.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.515 ' HD3' ' HG3' ' A' ' 26' ' ' GLU . 2.1 mptm? -103.26 -4.08 24.78 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -178.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.689 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 25.2 t70 -83.41 134.0 34.9 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.843 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -66.25 -41.34 90.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.851 -175.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -74.32 -35.49 63.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.776 0.322 . . . . 0.0 110.393 -174.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.8 t -55.67 -47.65 78.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.774 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.689 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 35.1 mt-30 -65.02 -31.75 73.13 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.155 0.502 . . . . 0.0 110.88 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.34 -46.49 88.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.464 176.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -65.52 -42.35 92.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.407 176.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.435 HD12 ' HA ' ' A' ' 38' ' ' LEU . 1.8 mm? -57.36 -44.43 84.35 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.703 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -73.75 -28.18 61.55 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.923 -177.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -66.47 -55.71 14.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.619 0.723 . . . . 0.0 110.474 178.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -102.47 30.23 4.74 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.627 -174.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -60.4 -27.41 67.43 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.124 -177.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -85.79 -24.1 26.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.885 0.374 . . . . 0.0 111.122 -179.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 22.0 t -93.4 -35.15 6.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.277 0.56 . . . . 0.0 111.147 -172.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.524 HG23 ' HE3' ' A' ' 49' ' ' MET . 50.7 mt -88.27 150.99 3.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.522 -178.004 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -119.34 163.2 17.53 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 29.9 mm-40 -59.61 -39.06 82.98 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.606 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -64.52 -38.05 89.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.045 0.45 . . . . 0.0 110.554 178.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.524 ' HE3' HG23 ' A' ' 45' ' ' ILE . 2.1 ttp -67.43 -31.93 72.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.224 178.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.0 mm -63.69 -46.39 94.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.256 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 9.7 mm-40 -67.37 -40.46 85.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.74 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -66.68 -43.52 84.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.02 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.6 m -98.98 19.31 15.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.002 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 42.8 tp -63.06 -30.12 71.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -61.83 -38.08 86.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.02 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 17.1 mmtm -74.95 -40.64 60.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.321 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.09 -41.06 97.8 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.331 0.586 . . . . 0.0 110.167 175.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -69.62 -44.47 70.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.539 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.543 ' HG2' ' NE2' ' A' ' 63' ' ' GLN . 45.3 tt0 -64.13 -35.4 80.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.344 178.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.542 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 26.3 t80 -56.15 -56.1 25.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.369 177.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.1 pt -69.31 -30.99 47.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.09 -174.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.464 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 11.0 pt-20 -80.53 -24.97 38.95 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.142 -0.623 . . . . 0.0 112.241 -174.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.543 ' NE2' ' HG2' ' A' ' 59' ' ' GLU . 49.7 mt-30 -77.76 -32.4 52.6 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.833 -176.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.441 ' OG ' ' HB2' ' A' ' 78' ' ' ASN . 10.9 m -178.84 118.37 0.07 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.047 -175.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.71 -51.79 6.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.8 0.81 . . . . 0.0 109.088 169.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.523 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 30.7 p30 -115.71 -157.81 0.66 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.948 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.474 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 8.2 p -152.62 163.55 39.41 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 44.4 t -54.92 -31.13 59.94 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 123.829 0.706 . . . . 0.0 111.286 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.443 ' HB2' ' HA2' ' A' ' 82' ' ' GLY . 0.1 OUTLIER -75.36 4.97 6.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.286 -0.416 . . . . 0.0 112.036 -178.656 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.9 p -151.64 19.25 0.71 Allowed 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.141 0.496 . . . . 0.0 110.352 175.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.6 t -129.65 153.38 48.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.414 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.5 tp10 -77.44 -27.1 52.05 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -84.6 129.25 34.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.349 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.96 -4.86 5.06 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.564 174.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -75.51 -40.56 56.93 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.209 -175.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 26.4 p -152.07 26.18 0.62 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.866 0.365 . . . . 0.0 110.934 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -68.89 -60.44 2.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.253 -173.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.474 ' OD1' ' HA ' ' A' ' 67' ' ' CYS . 1.3 p-10 -160.97 156.98 25.61 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.28 -0.418 . . . . 0.0 109.928 -177.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -74.06 -56.81 4.48 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.789 0.328 . . . . 0.0 111.161 -174.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 29.1 mt -82.29 81.25 8.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.43 0.633 . . . . 0.0 111.058 -176.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -64.59 129.34 39.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.767 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.443 ' HA2' ' HB2' ' A' ' 69' ' ' TYR . . . 97.52 -9.02 64.47 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.346 178.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.714 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 44.7 m-85 -125.0 157.93 34.94 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 111.394 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.523 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 12.5 m170 -129.61 155.29 80.51 Favored Pre-proline 0 CA--C 1.51 -0.59 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 171.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.542 ' O ' ' HE1' ' A' ' 60' ' ' TYR . 38.2 Cg_endo -77.81 151.61 28.17 Favored 'Trans proline' 0 N--CA 1.446 -1.318 0 C-N-CA 122.096 1.864 . . . . 0.0 110.717 172.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.457 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 31.5 ttpt -144.83 141.35 29.07 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 176.274 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -78.7 140.01 38.4 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 32.2 m -132.26 147.84 32.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 175.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 p -98.17 114.4 35.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.406 0.622 . . . . 0.0 110.298 178.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -117.42 96.32 5.35 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.556 178.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.83 -107.38 2.07 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.066 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -116.96 19.16 14.46 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.218 0.533 . . . . 0.0 110.482 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.8 p -135.42 141.77 45.5 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.234 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.1 mt -96.54 131.84 42.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.116 178.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -120.48 178.13 4.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.636 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 70.8 mt -132.93 114.53 22.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.851 0.357 . . . . 0.0 110.934 -176.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 9.4 pt-20 -103.13 -177.05 3.26 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.714 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 2.9 m-85 -130.25 123.61 30.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.107 0.48 . . . . 0.0 110.587 175.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.457 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 51.2 p90 -112.75 151.88 29.77 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 176.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.408 ' HA ' ' HA ' ' A' ' 83' ' ' TYR . 5.4 pt-20 -84.42 133.26 34.51 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.744 0.783 . . . . 0.0 111.467 -178.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.502 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 6.6 t -46.8 123.49 7.65 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.803 -178.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.93 -10.79 29.7 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.801 2.334 . . . . 0.0 112.442 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 59.6 t -69.0 -20.44 24.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.925 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.502 ' HG2' ' O ' ' A' ' 101' ' ' CYS . 22.3 ptmt -67.87 -23.65 65.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.683 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -105.13 119.56 39.33 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.206 0.527 . . . . 0.0 110.132 177.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.694 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.636 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.103 0 CA-C-O 121.064 0.459 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -72.85 147.41 88.8 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.633 -175.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.0 105.06 0.21 Allowed 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.728 2.285 . . . . 0.0 111.05 175.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 65.1 mt -60.1 122.7 11.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.339 -174.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -134.09 119.06 2.16 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 177.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -89.39 134.41 34.09 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 -177.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.7 m -63.31 -21.56 66.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.3 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 41.0 mt -83.02 87.97 6.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.089 0.471 . . . . 0.0 111.31 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -83.84 -47.66 10.86 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 171.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -131.4 109.08 0.85 Allowed Glycine 0 N--CA 1.444 -0.789 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.562 175.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.433 HG13 ' HG3' ' A' ' 14' ' ' ARG . 17.3 t -75.2 98.64 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 120.817 0.341 . . . . 0.0 110.383 -177.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 t -82.93 -38.13 23.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.685 -177.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -104.75 131.12 10.5 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.508 -0.854 . . . . 0.0 111.487 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.433 ' HG3' HG13 ' A' ' 11' ' ' VAL . 0.1 OUTLIER -143.69 65.09 14.07 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.918 0.359 . . . . 0.0 110.675 -177.655 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.512 ' HB2' ' HG2' ' A' ' 18' ' ' GLN . 28.7 Cg_exo -62.02 105.61 0.4 Allowed 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.314 2.01 . . . . 0.0 111.524 173.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -55.71 -37.37 68.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.231 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -54.58 -56.16 21.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.685 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.517 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 2.9 pt20 -71.5 -30.29 65.79 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.733 -177.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.4 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 29.9 mtpp -59.01 -47.92 83.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.533 178.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 19.7 ptt180 -77.49 -29.98 52.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.694 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.517 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 23.5 tp -61.1 -50.02 74.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.899 179.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -75.68 -27.2 58.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.097 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 34.1 tt0 -62.25 -54.87 34.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.931 0.396 . . . . 0.0 110.551 178.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.675 ' HE2' HD11 ' A' ' 54' ' ' LEU . 25.3 ptm -65.67 -36.99 85.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.025 177.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 11.7 tptm -54.3 -49.33 69.91 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.695 175.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -60.14 -48.3 82.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.996 -175.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -57.34 -40.3 77.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.111 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.455 HG21 ' O ' ' A' ' 24' ' ' MET . 60.7 t -70.96 -33.89 53.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.168 0.509 . . . . 0.0 110.393 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.5 mmt -71.03 -14.01 62.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.125 -176.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.77 14.51 12.56 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.683 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 18.3 t70 -85.31 135.48 33.89 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.549 176.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -63.99 -47.31 80.84 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.83 -175.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -70.48 -34.04 71.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.893 0.377 . . . . 0.0 110.405 -175.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 76.4 t -58.59 -43.23 86.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.761 174.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.683 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 61.9 mm-40 -59.59 -49.06 79.22 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.171 0.51 . . . . 0.0 110.527 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.52 -43.48 75.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.609 -177.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.511 ' CE2' HD12 ' A' ' 45' ' ' ILE . 78.3 t80 -72.28 -40.98 67.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.057 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.91 HD11 HD12 ' A' ' 50' ' ' ILE . 1.9 mm? -60.11 -45.54 92.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.538 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -73.71 -26.15 60.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.536 -178.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -66.35 -54.92 18.97 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.384 0.612 . . . . 0.0 110.307 176.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -105.69 32.64 4.2 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.483 -173.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -62.43 -24.45 67.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.944 0.402 . . . . 0.0 111.178 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -68.5 -36.42 78.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.336 0.588 . . . . 0.0 110.011 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 15.4 t -93.9 -43.21 13.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.83 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.511 HD12 ' CE2' ' A' ' 37' ' ' PHE . 67.9 mt -75.63 144.21 12.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.864 -176.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -131.25 176.72 8.04 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.405 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 99.3 mt-30 -59.74 -39.93 86.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.763 0.316 . . . . 0.0 111.82 -177.446 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -72.8 -36.8 67.66 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.935 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.584 ' HE2' ' HA ' ' A' ' 92' ' ' ARG . 53.6 ttm -56.47 -36.58 69.25 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 174.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.91 HD12 HD11 ' A' ' 38' ' ' LEU . 37.2 mm -61.48 -54.71 31.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.996 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.575 ' HA ' HD22 ' A' ' 54' ' ' LEU . 29.7 mt-10 -68.82 -34.6 75.78 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -178.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.4 tptp -65.02 -26.54 68.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.906 0.384 . . . . 0.0 110.525 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -115.2 16.36 16.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.38 -178.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.675 HD11 ' HE2' ' A' ' 24' ' ' MET . 0.1 OUTLIER -58.83 -41.16 86.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.613 -178.685 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -55.48 -43.77 75.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.436 176.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.496 ' O ' HD12 ' A' ' 96' ' ' ILE . 33.2 mmtp -71.49 -48.38 49.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.861 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.57 -42.26 87.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.034 0.445 . . . . 0.0 110.753 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -70.08 -39.44 75.59 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.423 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.01 -40.13 92.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.038 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.45 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 70.0 t80 -63.25 -50.49 69.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.979 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.1 pt -70.28 -31.27 46.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -171.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -85.38 -25.67 26.92 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.335 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 0.8 OUTLIER -75.06 160.99 29.83 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.603 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.9 p -64.1 120.52 12.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.696 0.284 . . . . 0.0 111.39 -176.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.451 ' HD3' ' O ' ' A' ' 65' ' ' LYS . 3.0 tmtp? -73.64 -31.74 63.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.526 0.679 . . . . 0.0 109.168 177.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -84.73 -165.4 1.17 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.215 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 p -157.8 159.85 37.17 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 176.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.449 ' HB2' ' HB2' ' A' ' 76' ' ' CYS . 22.8 t -67.42 -23.43 65.55 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.054 0.454 . . . . 0.0 110.509 -172.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -68.1 -9.09 43.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.696 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.2 p -133.42 1.24 3.42 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 28.8 m -122.64 140.51 52.75 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -81.09 57.3 3.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.928 0.87 . . . . 0.0 110.407 -177.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -154.32 124.71 6.95 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.231 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -100.35 0.16 39.47 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.357 -176.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -88.45 53.24 2.66 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 78' ' ' ASN . 49.7 t -84.55 129.98 34.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.59 -1.187 . . . . 0.0 111.154 -172.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -80.13 -17.42 52.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.001 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.451 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 39.0 t30 -57.97 136.86 57.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.508 -177.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.7 mt -81.86 -56.52 3.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.859 -179.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.405 ' HB2' ' CE2' ' A' ' 98' ' ' TYR . 3.9 mm? -85.34 79.36 9.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.715 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -73.5 138.71 45.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.562 0.696 . . . . 0.0 110.67 -176.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.55 -8.58 68.91 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.956 -171.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.439 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 74.4 m-85 -122.78 168.91 11.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 178.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.403 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 15.7 m170 -128.41 149.12 70.69 Favored Pre-proline 0 C--O 1.236 0.383 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 170.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -70.74 142.67 44.14 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.78 2.32 . . . . 0.0 112.866 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.472 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 16.6 ttmm -133.48 137.19 45.55 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.179 177.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.1 mt -83.66 130.63 34.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.198 176.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.43 HG23 ' HG2' ' A' ' 97' ' ' GLU . 16.0 m -132.11 149.86 33.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.48 178.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.6 p -97.64 118.03 43.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.201 0.524 . . . . 0.0 110.697 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -122.31 98.04 5.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.014 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.53 -112.01 4.58 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.995 -177.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.584 ' HA ' ' HE2' ' A' ' 49' ' ' MET . 17.7 mmt180 -112.6 15.49 20.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.155 0.503 . . . . 0.0 110.512 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.9 p -125.78 131.12 52.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.075 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.5 mt -91.04 129.16 42.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -119.27 177.83 4.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.952 0.406 . . . . 0.0 110.847 -170.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.496 HD12 ' O ' ' A' ' 56' ' ' LYS . 56.5 mt -127.7 106.87 15.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.587 -177.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.43 ' HG2' HG23 ' A' ' 88' ' ' VAL . 57.3 mm-40 -97.31 178.9 5.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.433 176.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.405 ' CE2' ' HB2' ' A' ' 80' ' ' LEU . 24.4 m-85 -132.16 130.71 41.45 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.159 0.504 . . . . 0.0 111.12 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.472 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 38.0 p90 -113.41 150.87 32.1 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.381 174.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.439 ' HG2' ' CE1' ' A' ' 83' ' ' TYR . 36.8 mt-10 -64.62 131.48 47.1 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.657 0.265 . . . . 0.0 110.907 -177.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.504 ' SG ' HG12 ' A' ' 103' ' ' VAL . 47.7 t -44.63 122.56 4.54 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.889 177.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.53 -12.67 21.82 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 123.241 2.627 . . . . 0.0 113.849 -175.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.504 HG12 ' SG ' ' A' ' 101' ' ' CYS . 4.5 p -67.77 -19.02 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 120.765 0.316 . . . . 0.0 110.525 178.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -66.9 -21.82 65.99 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 121.068 0.461 . . . . 0.0 110.515 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -78.04 91.33 4.25 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 178.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm . . . . . 0 C--N 1.322 -0.619 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.914 -175.856 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ptt? . . . . . 0 N--CA 1.482 1.139 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -115.68 86.83 16.35 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 177.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -71.96 110.03 2.82 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 123.049 2.499 . . . . 0.0 112.673 -176.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.8 mm -87.84 -31.88 5.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.614 0.721 . . . . 0.0 109.51 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -82.43 63.86 4.36 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.882 178.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -97.87 2.64 49.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.944 0.402 . . . . 0.0 111.057 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.2 m -81.95 68.52 8.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.023 0.44 . . . . 0.0 110.422 178.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 8' ' ' LEU . 3.2 mm? -75.85 4.46 8.04 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.486 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -78.17 -34.76 49.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 61.88 -163.31 24.87 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 115.639 -0.709 . . . . 0.0 113.244 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.9 m -136.51 124.11 33.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.868 0.366 . . . . 0.0 110.115 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.2 t -74.96 -26.54 59.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.11 0.481 . . . . 0.0 110.519 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -100.11 129.09 9.78 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 176.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -143.79 84.33 9.89 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-O 121.344 0.592 . . . . 0.0 111.206 -175.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.682 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 55.2 Cg_endo -70.36 134.98 27.95 Favored 'Trans proline' 0 C--N 1.331 -0.365 0 C-N-CA 123.389 2.726 . . . . 0.0 111.913 174.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.517 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 2.1 p-10 -72.55 -22.6 60.98 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -55.48 -53.06 61.06 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.539 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.682 ' HG2' ' HG2' ' A' ' 15' ' ' PRO . 2.0 pt20 -63.66 -31.23 72.33 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.888 -177.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.517 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 43.1 mtmt -64.36 -36.67 84.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.576 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.466 ' O ' ' HG2' ' A' ' 24' ' ' MET . 8.6 mtt180 -71.77 -50.65 28.05 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.457 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.8 tp -54.21 -49.64 68.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.049 -175.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -74.67 -34.58 62.71 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.97 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 8.2 tt0 -63.44 -56.19 18.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.777 0.323 . . . . 0.0 110.862 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.582 ' O ' HG21 ' A' ' 28' ' ' VAL . 25.4 ptm -61.7 -37.64 84.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.747 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.537 ' HA ' ' HE3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -66.93 -44.55 80.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.154 178.707 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -65.03 -37.21 86.86 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -58.06 -44.16 87.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.698 175.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.582 HG21 ' O ' ' A' ' 24' ' ' MET . 78.1 t -64.62 -36.08 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.956 178.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.446 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 88.9 mmm -84.97 0.14 52.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.071 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.87 -35.99 13.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.436 0.636 . . . . 0.0 110.331 175.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.68 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 21.7 t70 -62.56 123.49 18.48 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.154 -171.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -60.65 -41.25 94.6 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.395 -176.547 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.462 ' CB ' ' HZ2' ' A' ' 65' ' ' LYS . 5.6 t0 -63.12 -46.85 85.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.918 -177.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.8 t -54.93 -47.11 76.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.404 176.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.68 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 55.5 mt-30 -62.31 -40.63 96.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.5 -176.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.54 -40.26 82.49 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.562 177.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.437 ' CE2' HD13 ' A' ' 45' ' ' ILE . 88.5 t80 -69.56 -39.79 77.18 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.397 177.274 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.554 HD13 HD11 ' A' ' 50' ' ' ILE . 2.6 mm? -63.08 -44.91 94.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.756 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -68.51 -29.12 67.65 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.104 0.478 . . . . 0.0 110.527 -177.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.47 -30.42 37.43 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.987 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -119.14 26.55 9.41 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -65.4 -17.64 64.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.097 0.475 . . . . 0.0 110.18 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.84 -31.76 69.81 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.118 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.5 t -108.19 -35.43 2.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.492 -172.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.437 HD13 ' CE2' ' A' ' 37' ' ' PHE . 68.9 mt -78.3 135.67 25.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.558 0.694 . . . . 0.0 111.516 -175.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -111.44 164.98 12.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.74 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -61.51 -37.23 82.94 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.347 0.594 . . . . 0.0 109.658 173.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.596 ' HB3' ' HZ3' ' A' ' 48' ' ' LYS . 1.9 mmmp? -63.07 -42.2 99.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.276 178.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 33.6 tpp -56.21 -42.29 76.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.289 176.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.554 HD11 HD13 ' A' ' 38' ' ' LEU . 35.9 mm -60.32 -39.35 80.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.517 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.51 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 41.8 mt-10 -65.58 -49.19 69.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.487 176.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.508 ' HE2' ' HA ' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -60.65 -47.16 87.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.14 -177.027 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.3 p -92.79 17.66 10.1 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.329 -175.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.51 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -52.45 -49.37 64.76 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.96 0.409 . . . . 0.0 110.786 -179.473 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -61.74 -42.32 98.81 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.681 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -61.15 -51.36 69.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.806 0.336 . . . . 0.0 110.388 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.411 HD11 ' HA ' ' A' ' 57' ' ' LEU . 3.9 mm? -59.95 -43.31 95.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.054 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -66.21 -42.62 88.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.411 -177.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -59.59 -36.43 76.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.352 0.596 . . . . 0.0 110.021 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -67.23 -45.38 76.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.885 -178.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.6 pt -75.36 -31.4 23.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -174.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -81.07 -27.05 35.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.589 0.233 . . . . 0.0 111.29 -177.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -80.25 173.99 12.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.055 0.455 . . . . 0.0 111.117 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.6 m -76.7 116.04 17.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.704 -179.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.462 ' HZ2' ' CB ' ' A' ' 33' ' ' ASP . 90.6 mttt -81.02 -35.76 31.47 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.129 0.49 . . . . 0.0 110.111 176.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -79.86 -177.02 5.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.952 177.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -150.79 156.81 42.02 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.632 -177.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.474 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 33.1 t -66.98 -19.01 65.65 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.223 -172.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.47 ' CE1' ' HA ' ' A' ' 104' ' ' LYS . 1.2 t80 -75.9 -2.23 29.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.066 0.46 . . . . 0.0 111.305 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 17.6 p -132.24 -44.28 0.94 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.559 176.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.6 p -80.53 152.09 28.84 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -81.97 -9.79 59.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.818 0.342 . . . . 0.0 110.768 -176.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . 0.449 ' HB2' ' HB2' ' A' ' 76' ' ' CYS . 7.4 m-20 -55.0 111.82 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.222 -175.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -70.4 -21.74 62.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.449 0.643 . . . . 0.0 109.273 171.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -86.98 4.84 40.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.563 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 73' ' ' ASP . 45.8 t -69.3 114.37 7.48 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.07 0.462 . . . . 0.0 110.506 -178.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -117.22 143.85 45.43 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -160.49 168.41 25.15 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.0 mt -75.26 -79.22 0.1 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.0 mp -88.34 93.86 9.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.206 173.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.474 ' CD ' ' H ' ' A' ' 68' ' ' SER . 2.2 mm-40 -76.19 151.52 36.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.354 0.597 . . . . 0.0 110.714 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.38 -9.74 72.01 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.028 -170.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.543 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 64.9 m-85 -122.47 172.12 8.59 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.477 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 14.5 m170 -128.92 144.35 52.19 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 172.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -75.34 130.76 13.22 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.446 2.097 . . . . 0.0 111.252 174.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.555 ' HD3' ' CD1' ' A' ' 99' ' ' TYR . 19.9 pttp -134.99 148.5 49.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.007 0.432 . . . . 0.0 109.994 175.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 73.2 mt -81.26 141.62 33.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.346 -175.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.7 m -135.95 154.23 33.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.562 175.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.6 p -107.05 114.02 45.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.343 0.592 . . . . 0.0 110.346 176.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -125.89 101.97 7.07 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.302 -177.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.73 -118.5 9.86 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.211 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.476 ' O ' ' HG3' ' A' ' 92' ' ' ARG . 20.7 tpp180 -105.2 19.52 20.45 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.978 0.894 . . . . 0.0 109.947 -179.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 43.3 t -136.16 136.53 40.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.25 0.548 . . . . 0.0 111.433 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 86.3 mt -89.61 119.54 36.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 169.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.57 177.71 4.54 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.852 0.358 . . . . 0.0 110.634 -172.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 53.3 mt -131.64 115.98 29.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.309 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -119.03 163.28 17.21 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 174.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.543 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 30.3 m-85 -103.92 141.21 36.55 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.096 -176.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.555 ' CD1' ' HD3' ' A' ' 86' ' ' LYS . 53.6 p90 -117.69 147.55 42.81 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 173.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.462 ' HG2' ' CE2' ' A' ' 83' ' ' TYR . 31.5 mt-10 -62.58 125.83 25.27 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.395 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.587 ' HB3' ' HB2' ' A' ' 104' ' ' LYS . 40.0 t -47.31 132.43 9.82 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.235 175.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -55.58 -29.29 69.26 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 122.537 2.158 . . . . 0.0 112.085 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.0 t -80.16 -17.9 12.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.38 178.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.587 ' HB2' ' HB3' ' A' ' 101' ' ' CYS . 14.2 tmtt? -81.67 -34.89 30.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.524 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 54.0 mtm180 -73.88 99.64 3.28 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.394 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 20.5 pttp . . . . . 0 C--N 1.319 -0.735 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.511 -176.023 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 121.211 0.529 . . . . 0.0 110.335 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -142.96 165.81 24.03 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.558 -176.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.54 86.86 0.27 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 121.95 1.767 . . . . 0.0 110.78 170.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.1 mm -79.12 -40.13 21.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.078 -176.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 159.69 128.18 0.96 Allowed Glycine 0 N--CA 1.443 -0.839 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.487 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.65 14.82 27.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.221 0.534 . . . . 0.0 110.577 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.4 t -118.05 99.31 6.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.308 177.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -76.04 -41.54 50.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.144 0.497 . . . . 0.0 109.726 -177.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.5 -175.0 2.65 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.01 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -100.83 91.8 1.0 Allowed Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.515 177.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.4 t -61.72 106.27 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.137 0.494 . . . . 0.0 110.5 -178.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -107.67 8.81 29.22 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.918 -176.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.456 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -119.63 117.08 3.48 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 175.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.456 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.0 OUTLIER -143.49 85.24 9.55 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 -177.051 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.435 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 20.3 Cg_endo -60.97 154.48 56.38 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.951 2.434 . . . . 0.0 111.996 176.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -58.44 -28.4 65.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.892 -178.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -55.85 -50.54 70.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.395 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -71.2 -34.3 70.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.895 0.378 . . . . 0.0 110.184 -176.878 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -62.47 -47.63 83.14 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.776 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.512 ' O ' ' HG2' ' A' ' 24' ' ' MET . 12.7 ptm180 -72.57 -32.34 65.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.563 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.617 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 36.4 tp -64.85 -50.28 67.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.152 -178.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -67.02 -29.92 69.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.272 0.558 . . . . 0.0 110.309 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -67.69 -54.75 16.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.5 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.512 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 25.7 ptm -68.66 -34.63 76.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.068 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.617 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 12.3 tptm -56.69 -51.79 67.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.312 0.577 . . . . 0.0 110.308 178.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.471 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 41.2 tt0 -65.41 -36.33 83.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.647 -179.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.7 mtpp -62.94 -36.45 83.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.731 178.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 24' ' ' MET . 95.9 t -70.73 -38.55 73.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.178 0.513 . . . . 0.0 109.738 177.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 25.9 mmt -77.36 5.27 9.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.042 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.471 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 1.9 mptp? -101.53 -13.7 17.78 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.775 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.665 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 35.5 t70 -85.6 142.59 29.0 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.257 0.551 . . . . 0.0 111.927 -172.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -72.48 -44.2 62.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.463 -176.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -67.8 -38.56 83.46 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 -178.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.416 ' O ' HD21 ' A' ' 38' ' ' LEU . 46.2 t -53.71 -46.54 62.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.873 175.199 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.665 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 59.0 mm-40 -57.92 -52.36 65.8 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.048 0.451 . . . . 0.0 110.852 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.46 97.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.516 -176.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.1 t80 -63.71 -40.05 95.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.635 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.537 HD12 HD11 ' A' ' 50' ' ' ILE . 2.2 mm? -62.13 -49.32 76.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.371 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -66.71 -28.09 68.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.249 0.547 . . . . 0.0 110.804 -177.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.44 -33.33 54.82 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.563 -178.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -119.16 25.67 10.0 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.393 -175.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -70.0 -17.02 63.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.636 0.255 . . . . 0.0 111.616 -175.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -71.79 -39.89 69.58 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.1 t -93.41 -41.44 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.737 -172.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.482 HG12 ' SD ' ' A' ' 49' ' ' MET . 64.9 mt -92.92 141.74 14.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.029 -176.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.473 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -131.54 -179.21 5.23 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.12 -36.85 80.84 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.539 0.2 . . . . 0.0 111.539 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -62.27 -48.74 78.6 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.482 ' SD ' HG12 ' A' ' 45' ' ' ILE . 44.5 ttm -60.1 -35.97 76.38 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.774 178.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.537 HD11 HD12 ' A' ' 38' ' ' LEU . 36.6 mm -63.53 -47.8 89.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.056 178.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -70.37 -30.56 67.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.951 0.405 . . . . 0.0 110.766 -178.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.472 ' N ' ' HE3' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -75.49 -40.9 56.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.041 179.189 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.426 ' HB2' HD12 ' A' ' 94' ' ' ILE . 15.4 m -95.87 21.3 8.74 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.475 178.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.2 tp -59.13 -40.75 86.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.408 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -59.68 -41.55 90.94 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.363 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.484 ' O ' HD13 ' A' ' 96' ' ' ILE . 73.7 mmtt -64.01 -53.44 49.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.759 178.631 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.414 HD13 HG23 ' A' ' 94' ' ' ILE . 11.0 mp -61.06 -39.12 88.66 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.151 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -67.49 -40.95 85.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.774 179.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -64.49 -37.8 88.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.342 0.591 . . . . 0.0 109.9 177.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.493 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 54.9 t80 -65.33 -47.1 77.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.162 -177.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.525 ' HA ' ' HE3' ' A' ' 65' ' ' LYS . 23.7 pt -70.32 -30.51 43.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 C-N-CA 121.148 -0.221 . . . . 0.0 111.508 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -81.34 -25.19 36.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.795 -179.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 2.2 pt20 -82.51 156.0 24.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.693 -178.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 14.5 m -62.48 109.46 1.38 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.455 -177.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.525 ' HE3' ' HA ' ' A' ' 61' ' ' ILE . 93.7 mttt -83.26 -41.0 18.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.911 178.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -78.75 171.53 15.02 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.167 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -141.16 154.01 45.65 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -178.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.539 ' HB2' ' OE2' ' A' ' 81' ' ' GLU . 72.5 m -74.31 -11.45 60.27 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.507 0.504 . . . . 0.0 111.442 -170.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.21 -0.43 19.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.001 174.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 28.6 p -143.67 -28.19 0.53 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.761 176.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.48 ' O ' ' HA ' ' A' ' 68' ' ' SER . 16.5 m -114.16 151.19 33.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -100.31 7.36 44.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.585 0.231 . . . . 0.0 111.211 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.13 104.36 0.14 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.369 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -83.01 -23.92 33.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.821 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -92.73 29.68 1.72 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.492 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 31.1 p -134.4 126.62 29.93 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 174.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -83.38 120.89 26.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.302 0.572 . . . . 0.0 109.834 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -111.06 109.83 20.1 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.316 0.579 . . . . 0.0 109.879 174.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.5 tt -57.65 -61.41 2.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.108 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.2 mp -86.47 162.95 17.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.574 173.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.539 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 6.8 tp10 -141.07 145.57 36.01 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.93 6.92 87.51 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -169.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.645 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 78.5 m-85 -134.51 154.98 51.16 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.76 0.314 . . . . 0.0 110.881 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 18.8 m170 -130.48 146.07 60.18 Favored Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 174.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.448 ' CG ' ' HA ' ' A' ' 65' ' ' LYS . 69.7 Cg_endo -78.05 143.16 20.15 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.191 1.927 . . . . 0.0 111.82 174.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -144.15 150.74 38.54 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 176.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 97.5 mt -75.75 137.57 40.67 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.025 176.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.446 HG21 ' OE2' ' A' ' 97' ' ' GLU . 30.2 m -130.58 148.52 33.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 116.28 -0.418 . . . . 0.0 109.931 177.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.3 p -87.87 116.27 29.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.555 0.693 . . . . 0.0 109.551 175.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.31 95.88 5.28 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.098 -176.051 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.81 -108.31 2.33 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.849 -176.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -117.67 19.29 13.92 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.306 0.574 . . . . 0.0 109.985 177.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 11.6 p -132.48 160.49 36.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.003 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.426 HD12 ' HB2' ' A' ' 53' ' ' SER . 47.1 mt -104.67 134.65 45.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -125.49 178.14 5.8 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -175.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.484 HD13 ' O ' ' A' ' 56' ' ' LYS . 26.9 mt -130.83 113.71 25.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.882 -178.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.446 ' OE2' HG21 ' A' ' 88' ' ' VAL . 32.8 mt-10 -126.85 159.38 34.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.585 -0.279 . . . . 0.0 110.287 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.645 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 8.0 m-85 -99.31 136.08 39.78 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.981 0.42 . . . . 0.0 112.026 -175.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -115.19 158.62 22.01 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 173.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.91 139.37 43.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.749 0.309 . . . . 0.0 110.614 -175.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 33.0 t -55.07 121.82 38.42 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.117 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.61 -9.25 25.56 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.374 2.05 . . . . 0.0 112.576 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 33.4 t -82.01 -13.53 12.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.182 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.9 tptp -77.51 -26.94 51.61 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.85 -178.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -134.35 112.03 10.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.853 0.358 . . . . 0.0 110.153 -177.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.678 -179.492 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 tpt . . . . . 0 N--CA 1.477 0.888 0 CA-C-O 120.796 0.331 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -169.76 86.28 0.58 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.751 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.51 85.92 0.45 Allowed 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 122.243 1.962 . . . . 0.0 111.924 177.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.5 tt -136.25 133.6 49.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.236 0.541 . . . . 0.0 110.931 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -128.82 90.44 0.32 Allowed Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.006 -0.837 . . . . 0.0 111.006 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -75.87 126.89 31.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.001 0.429 . . . . 0.0 110.764 -174.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.1 m -85.13 78.79 9.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.932 -178.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 41.6 tp -81.57 73.52 8.61 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 175.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -161.32 155.19 22.16 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.358 -176.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -151.38 -169.8 17.47 Favored Glycine 0 N--CA 1.447 -0.612 0 N-CA-C 111.436 -0.666 . . . . 0.0 111.436 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.8 t -84.06 105.78 13.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.248 0.547 . . . . 0.0 109.904 -179.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 22.9 m -147.05 157.58 43.66 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.411 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -75.89 161.64 52.39 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.754 177.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.411 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.2 OUTLIER -141.96 84.24 12.01 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 -179.0 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.473 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 15.0 Cg_endo -58.46 132.67 49.92 Favored 'Trans proline' 0 C--O 1.233 0.234 0 C-N-CA 122.927 2.418 . . . . 0.0 111.522 175.39 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.928 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 9.9 t70 -69.73 -24.9 63.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.639 -176.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -53.26 -55.97 20.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.485 178.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.55 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 2.3 pt20 -66.17 -31.22 71.94 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.739 0.304 . . . . 0.0 110.761 -177.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.928 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 50.4 mtpt -58.27 -42.12 85.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.388 177.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.691 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 23.2 mtp180 -78.8 -41.36 30.54 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.902 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.55 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 30.1 tp -54.27 -49.75 68.85 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.737 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -75.92 -28.52 58.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.018 0.437 . . . . 0.0 110.759 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 7.7 tt0 -62.41 -55.27 29.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.913 176.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.466 ' O ' HG21 ' A' ' 28' ' ' VAL . 27.1 ptm -62.99 -35.86 81.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.755 -179.194 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.66 ' O ' ' HG2' ' A' ' 29' ' ' MET . 4.1 tppp? -55.82 -53.86 51.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 173.119 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.627 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 2.3 tt0 -55.07 -48.16 73.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.651 178.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.442 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 12.5 mmmt -51.84 -42.23 62.43 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.064 178.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.533 ' HA ' HD11 ' A' ' 61' ' ' ILE . 78.6 t -69.89 -37.61 73.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 121.212 0.53 . . . . 0.0 110.3 -177.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.66 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 29.1 mmm -75.23 5.82 5.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.557 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.627 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 30.5 mmtp -102.81 -18.27 15.19 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.645 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 23.1 t70 -81.27 129.28 34.54 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.731 -0.388 . . . . 0.0 111.142 -175.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -62.66 -36.58 83.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.826 -0.624 . . . . 0.0 112.2 -175.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -73.74 -36.75 65.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.834 0.35 . . . . 0.0 110.402 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 32.8 t -57.72 -50.09 78.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.406 173.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.645 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 45.8 mt-30 -61.32 -41.29 96.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.577 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -58.86 -40.84 85.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.67 177.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -67.79 -41.39 83.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.765 177.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.503 HD12 HD12 ' A' ' 50' ' ' ILE . 1.9 mm? -60.75 -45.37 94.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.366 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -72.87 -25.1 60.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.01 0.433 . . . . 0.0 110.797 -178.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.435 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -78.85 -32.13 45.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.683 -177.512 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -122.73 28.33 7.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.278 -178.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -62.84 -23.86 67.5 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.935 0.398 . . . . 0.0 111.43 -178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -70.79 -32.95 70.22 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.289 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.9 t -94.74 -44.53 13.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.926 -172.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.6 mt -79.8 142.87 13.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.328 -174.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -127.95 176.3 7.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.423 175.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.553 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 49.1 mt-30 -58.77 -46.4 87.57 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -177.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -60.01 -40.0 87.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.756 0.312 . . . . 0.0 111.297 -178.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.479 ' HG2' HG13 ' A' ' 94' ' ' ILE . 44.1 ttm -60.06 -43.39 95.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.476 177.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.503 HD12 HD12 ' A' ' 38' ' ' LEU . 38.2 mm -62.79 -44.71 99.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.061 178.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 13.7 mm-40 -61.89 -36.42 81.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.595 -177.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.9 mtmt -75.31 -44.17 46.92 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.793 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.485 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 26.0 m -91.93 19.65 6.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.588 -174.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.457 ' HG ' ' HE3' ' A' ' 24' ' ' MET . 45.9 tp -62.47 -37.9 87.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.853 0.358 . . . . 0.0 110.317 178.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -62.18 -39.99 94.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.352 176.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.56 ' O ' HD12 ' A' ' 96' ' ' ILE . 70.2 mmtt -61.53 -53.32 57.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.1 0.476 . . . . 0.0 110.885 178.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.16 -36.58 84.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.354 -177.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -69.58 -42.42 74.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.796 0.331 . . . . 0.0 110.157 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -56.18 -42.8 77.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.965 175.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.475 ' HA ' HE21 ' A' ' 63' ' ' GLN . 76.2 t80 -61.52 -46.97 87.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.418 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.533 HD11 ' HA ' ' A' ' 28' ' ' VAL . 36.2 pt -75.38 -31.14 23.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 -175.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -84.1 -19.33 34.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.762 0.315 . . . . 0.0 111.078 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.475 HE21 ' HA ' ' A' ' 60' ' ' TYR . 24.7 pt20 -88.08 -178.05 5.88 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 173.454 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.0 m -71.75 124.62 25.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.118 0.485 . . . . 0.0 111.345 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -78.17 -27.09 47.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.922 174.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.539 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 79.0 m-20 -99.92 -164.6 1.14 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.005 175.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.7 p -146.18 156.77 43.64 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 176.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 t -66.0 -13.34 59.69 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.212 0.529 . . . . 0.0 111.12 -173.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -78.49 -3.4 43.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.733 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.4 p -134.77 -38.92 0.8 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.235 176.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.1 p -83.39 130.55 35.05 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 177.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -95.98 0.58 51.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.25 0.548 . . . . 0.0 110.989 -176.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -75.31 104.22 5.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.374 171.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.92 5.85 20.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.772 -175.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -70.45 -40.18 73.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.913 0.387 . . . . 0.0 110.378 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 72.5 m -86.96 113.62 22.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.593 176.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -105.42 144.58 32.0 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 173.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.66 ' HB3' ' HG ' ' A' ' 80' ' ' LEU . 44.1 m-80 -142.13 158.21 44.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.16 -175.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.43 -22.14 55.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.367 0.603 . . . . 0.0 109.399 171.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.66 ' HG ' ' HB3' ' A' ' 78' ' ' ASN . 2.6 pp -82.42 126.24 31.98 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.259 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -143.55 118.01 9.7 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.961 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.27 -8.18 68.8 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.844 -176.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.417 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 89.8 m-85 -126.28 162.19 26.04 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.539 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 16.1 m170 -125.92 148.54 63.04 Favored Pre-proline 0 CA--C 1.514 -0.416 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.31 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.419 ' O ' ' HE1' ' A' ' 60' ' ' TYR . 42.2 Cg_endo -69.81 144.27 53.24 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.226 1.951 . . . . 0.0 111.593 175.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.463 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 59.9 tttp -146.75 134.15 20.75 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.25 -178.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -71.74 131.54 43.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 178.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 35.1 m -129.13 152.15 36.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.131 177.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -99.15 112.1 30.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.366 0.603 . . . . 0.0 109.55 173.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -110.19 96.82 6.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.819 -178.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.36 -99.87 0.68 Allowed Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.527 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -118.63 3.41 11.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.665 0.269 . . . . 0.0 111.405 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.4 t -124.35 150.69 45.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.784 0.326 . . . . 0.0 110.826 -176.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.485 ' HB ' ' CB ' ' A' ' 53' ' ' SER . 66.5 mt -94.33 139.13 19.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 176.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -135.57 178.39 7.08 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -175.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.56 HD12 ' O ' ' A' ' 56' ' ' LYS . 65.6 mt -121.16 101.34 10.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.616 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -95.97 -170.46 2.13 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.672 176.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.426 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 43.7 m-85 -133.65 141.89 47.81 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.281 0.562 . . . . 0.0 111.71 -175.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.463 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 46.0 p90 -122.26 151.39 41.13 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.213 172.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.417 ' HG2' ' CE1' ' A' ' 83' ' ' TYR . 41.5 mt-10 -65.77 127.76 33.27 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.193 -177.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.481 ' SG ' HG11 ' A' ' 103' ' ' VAL . 49.8 t -48.34 123.31 10.76 Favored Pre-proline 0 N--CA 1.463 0.219 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.482 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -67.83 5.57 1.02 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 123.266 2.644 . . . . 0.0 113.886 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.481 HG11 ' SG ' ' A' ' 101' ' ' CYS . 5.9 p -86.33 -19.54 8.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 O-C-N 122.1 -0.375 . . . . 0.0 110.464 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -67.98 -51.63 45.13 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.298 -176.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -136.05 30.26 3.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.185 -178.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.7 mttm . . . . . 0 C--O 1.236 0.363 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.144 -178.545 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.9 mmm . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.896 0.379 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.487 ' OE1' ' HD2' ' A' ' 6' ' ' ARG . 26.7 mt-10 -138.91 153.07 71.52 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.682 -178.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -75.34 177.46 8.62 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.667 2.244 . . . . 0.0 112.998 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.488 HD13 ' O ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -78.3 4.09 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 121.881 0.848 . . . . 0.0 110.287 -177.107 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.76 -20.31 59.48 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.209 177.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.487 ' HD2' ' OE1' ' A' ' 2' ' ' GLU . 20.8 mtp180 -75.3 79.03 2.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.806 0.336 . . . . 0.0 110.163 175.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.5 m -84.97 93.99 8.69 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.178 0.513 . . . . 0.0 110.724 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 48.6 tp -68.68 -26.95 65.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.934 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -87.76 14.88 7.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.105 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.55 -14.95 80.72 Favored Glycine 0 N--CA 1.451 -0.36 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.455 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.1 t -83.17 97.83 4.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 176.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 p -68.55 -58.19 4.66 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.759 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -148.9 126.99 2.38 Favored Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.376 -0.916 . . . . 0.0 112.664 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.455 ' HA ' ' HD2' ' A' ' 15' ' ' PRO . 17.8 ttt180 -154.89 85.8 3.55 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 175.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.455 ' HD2' ' HA ' ' A' ' 14' ' ' ARG . 8.5 Cg_endo -48.74 137.09 27.38 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 124.141 3.227 . . . . 0.0 113.646 -174.123 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.55 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 6.3 p-10 -63.71 -21.37 66.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.624 178.502 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -53.61 -58.62 6.52 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.702 175.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -30.8 65.8 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.768 -178.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.55 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 52.9 mtmt -64.08 -45.55 88.21 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.066 -0.254 . . . . 0.0 110.672 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -71.87 -37.54 70.17 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 178.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.4 tp -63.19 -49.92 72.36 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.946 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -65.95 -35.81 81.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.524 177.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -62.52 -59.11 5.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.161 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.422 ' HE3' HD21 ' A' ' 54' ' ' LEU . 22.7 ptm -61.63 -40.49 95.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.938 -177.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.462 ' HZ3' ' CG2' ' A' ' 50' ' ' ILE . 55.3 tptt -62.0 -43.19 99.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.959 0.409 . . . . 0.0 109.978 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.409 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 3.2 tp10 -60.53 -46.54 89.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.579 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -64.5 -41.81 96.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.171 -176.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 71.5 t -70.98 -44.51 75.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.082 -175.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.463 ' C ' ' HD3' ' A' ' 30' ' ' LYS . 90.6 mmm -71.07 -15.24 62.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.865 0.364 . . . . 0.0 110.805 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.463 ' HD3' ' C ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -110.48 13.65 22.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.716 -178.761 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.566 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 26.5 t70 -85.41 131.74 34.34 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 170.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -61.31 -38.14 85.77 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.419 0.449 . . . . 0.0 111.845 -174.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -71.38 -47.22 57.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.168 0.509 . . . . 0.0 109.669 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.6 t -55.06 -55.13 17.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.496 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.588 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 5.0 pt20 -65.78 -27.73 68.5 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.461 ' HA ' ' HZ2' ' A' ' 39' ' ' LYS . . . -62.79 -45.66 91.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.309 0.576 . . . . 0.0 109.739 173.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -66.81 -40.78 88.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.711 176.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.68 HD13 HD13 ' A' ' 50' ' ' ILE . 1.6 mm? -58.99 -48.88 79.97 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.949 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.588 ' HG2' ' O ' ' A' ' 35' ' ' GLN . 17.9 pttm -73.55 -24.0 60.06 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.015 -178.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.43 -41.26 76.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.118 0.485 . . . . 0.0 110.229 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -115.41 28.99 8.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.526 -174.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -69.2 -14.9 63.24 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.149 0.5 . . . . 0.0 110.62 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.54 -31.22 71.17 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.677 0.751 . . . . 0.0 109.625 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.1 t -106.05 -41.77 6.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.512 -172.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.9 mt -87.32 141.71 13.97 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.761 -171.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -124.26 178.07 5.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.361 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.453 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 77.3 mt-30 -58.88 -46.05 88.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.635 0.255 . . . . 0.0 111.156 -178.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 27.2 mmtm -68.54 -35.41 77.41 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -174.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 51.9 ttm -59.51 -32.06 69.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 171.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.68 HD13 HD13 ' A' ' 38' ' ' LEU . 42.3 mm -72.18 -46.59 57.56 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.594 177.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 1.7 mp0 -58.13 -46.02 86.35 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 120.97 0.414 . . . . 0.0 111.016 175.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 50.3 tptt -58.82 -40.28 83.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.821 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -104.22 17.83 23.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.981 -175.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.422 HD21 ' HE3' ' A' ' 24' ' ' MET . 0.7 OUTLIER -60.02 -43.38 95.31 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.138 0.494 . . . . 0.0 110.114 -177.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -57.58 -40.1 78.23 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.182 176.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.565 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 6.9 mmpt? -71.46 -48.19 50.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.633 0.254 . . . . 0.0 111.272 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.47 HD22 HG21 ' A' ' 94' ' ' ILE . 95.1 mt -61.26 -39.71 91.36 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.103 0.478 . . . . 0.0 110.593 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -68.07 -40.12 82.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.243 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.73 -37.04 77.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.24 176.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -66.35 -43.68 85.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.907 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 pt -75.2 -29.92 22.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 120.713 -0.395 . . . . 0.0 112.037 -174.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -80.93 -27.05 36.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.699 0.285 . . . . 0.0 111.329 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -80.44 -176.96 5.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.928 0.394 . . . . 0.0 110.693 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.1 m -79.09 124.14 28.01 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.165 -176.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -77.67 -27.1 50.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.345 0.593 . . . . 0.0 109.99 171.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -97.97 -167.04 1.46 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.437 178.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -153.53 155.19 35.74 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.3 m -72.04 -20.08 61.74 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.301 -171.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -63.19 -21.09 65.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.167 177.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 16.3 p -115.45 -54.48 2.53 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.515 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -91.65 -179.16 5.27 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.016 -175.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.492 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 0.8 OUTLIER -93.76 24.67 3.99 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.607 -177.59 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -60.56 108.78 0.88 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.333 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -69.6 -15.28 63.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.128 0.489 . . . . 0.0 110.163 178.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -73.54 68.14 1.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.293 0.568 . . . . 0.0 109.865 174.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 40.8 m -85.13 17.32 3.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.802 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -92.1 12.84 20.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.229 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.65 ' HB2' ' HG2' ' A' ' 81' ' ' GLU . 77.0 m-20 -62.23 110.49 1.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 172.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.444 ' HG ' HD21 ' A' ' 80' ' ' LEU . 2.2 pt? -56.19 -50.99 69.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.123 -178.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.444 HD21 ' HG ' ' A' ' 79' ' ' LEU . 3.9 mm? -88.02 62.15 6.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.509 0.195 . . . . 0.0 111.0 173.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.65 ' HG2' ' HB2' ' A' ' 78' ' ' ASN . 1.6 mm-40 -72.8 159.75 33.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.959 0.409 . . . . 0.0 110.113 177.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 79.95 -8.66 49.68 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.038 -174.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.415 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 35.0 m-85 -122.17 172.57 8.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.0 m170 -129.76 144.41 52.89 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 171.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.06 135.5 19.05 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.428 2.085 . . . . 0.0 112.328 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -136.6 133.58 36.48 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 93.8 mt -71.44 138.38 49.01 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.183 -176.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.489 HG23 ' HG3' ' A' ' 97' ' ' GLU . 30.7 m -134.33 149.92 30.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.821 177.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.6 p -103.58 117.91 49.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-O 121.089 0.471 . . . . 0.0 109.983 174.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -117.97 93.92 4.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.765 -177.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 58.62 -87.96 0.02 OUTLIER Glycine 0 CA--C 1.521 0.409 0 CA-C-N 115.463 -0.79 . . . . 0.0 114.461 175.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.716 ' HD3' ' H ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -99.07 -15.19 19.11 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -170.292 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.6 p -148.6 170.73 17.46 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.224 0.535 . . . . 0.0 111.569 -173.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.47 HG21 HD22 ' A' ' 57' ' ' LEU . 59.4 mt -106.78 136.49 41.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.377 -179.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -130.06 179.2 6.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.899 0.38 . . . . 0.0 110.732 -173.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 57.9 mt -127.22 114.11 35.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.259 -178.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.489 ' HG3' HG23 ' A' ' 88' ' ' VAL . 31.6 mt-10 -114.39 153.19 30.29 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.415 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 38.2 m-85 -105.68 130.39 53.71 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.123 0.487 . . . . 0.0 111.923 -173.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.3 p90 -106.67 149.66 27.03 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 171.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -69.75 139.79 53.35 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.214 -0.594 . . . . 0.0 110.701 -174.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.567 ' SG ' HG11 ' A' ' 103' ' ' VAL . 49.2 t -48.07 123.69 10.38 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.241 177.144 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.96 -14.02 40.82 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.306 2.671 . . . . 0.0 113.887 -172.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.567 HG11 ' SG ' ' A' ' 101' ' ' CYS . 8.4 p -67.81 -25.17 31.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.977 0.418 . . . . 0.0 110.408 178.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -75.74 -47.39 26.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.679 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -101.24 90.49 4.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.274 -174.626 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.9 mttp . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.518 -179.745 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.434 ' CG ' ' HD2' ' A' ' 3' ' ' PRO . 26.4 tt0 -112.97 144.15 30.51 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.434 ' HD2' ' CG ' ' A' ' 2' ' ' GLU . 5.9 Cg_endo -48.3 116.62 2.11 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.063 2.509 . . . . 0.0 112.285 177.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.8 mp -84.69 -29.9 6.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.495 178.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.82 -128.48 8.62 Favored Glycine 0 N--CA 1.444 -0.821 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.254 -177.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.473 ' HB2' ' HG ' ' A' ' 8' ' ' LEU . 9.5 ptt180 -144.84 136.91 25.94 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.958 0.409 . . . . 0.0 110.692 178.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.4 m -90.74 19.09 5.73 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.701 -172.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.473 ' HG ' ' HB2' ' A' ' 6' ' ' ARG . 1.6 pp -86.09 25.94 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.202 0.525 . . . . 0.0 110.788 177.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -111.95 128.09 56.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.718 -174.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.54 -64.05 4.34 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 113.968 172.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 t -70.11 94.71 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.127 0.489 . . . . 0.0 111.792 -172.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.8 p -98.94 16.49 22.29 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.498 0.665 . . . . 0.0 110.411 175.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -79.2 75.37 2.08 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.483 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -142.65 62.97 13.47 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 178.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.594 ' HD2' ' HG2' ' A' ' 18' ' ' GLN . 41.8 Cg_endo -68.82 159.57 53.23 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 121.721 1.614 . . . . 0.0 110.816 172.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -65.38 -19.44 65.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.024 0.44 . . . . 0.0 110.217 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.515 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 81.3 t80 -63.52 -51.79 63.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.839 175.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.594 ' HG2' ' HD2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -71.17 -31.84 68.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -177.514 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -64.14 -48.86 74.38 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.702 177.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 17' ' ' PHE . 6.1 ptp180 -64.89 -31.41 72.63 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.8 tp -68.67 -49.37 59.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.254 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.5 -35.81 81.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.937 0.399 . . . . 0.0 110.03 176.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -60.98 -55.48 32.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.265 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.542 ' HE3' ' HG ' ' A' ' 54' ' ' LEU . 24.8 ptm -65.27 -38.34 89.99 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.153 -179.182 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.5 tptm -63.56 -41.71 98.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.155 0.503 . . . . 0.0 110.013 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.466 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 15.2 tm-20 -58.34 -47.11 84.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.954 177.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -58.63 -55.23 37.77 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.706 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.419 HG21 ' O ' ' A' ' 24' ' ' MET . 96.3 t -62.65 -42.21 95.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.949 0.404 . . . . 0.0 111.167 -174.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.5 mmt -77.51 -5.62 50.67 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -174.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HE3' ' O ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -127.24 6.51 6.43 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.306 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.576 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 0.8 OUTLIER -84.23 136.91 33.76 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.343 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -60.09 -49.18 78.67 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.325 -169.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -65.24 -35.79 82.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.153 0.502 . . . . 0.0 110.669 -174.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 99.5 t -62.21 -37.82 79.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.095 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 70.8 mm-40 -58.73 -44.69 90.54 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.321 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.99 -48.17 82.53 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.107 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -62.23 -41.83 98.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.514 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' A' ' 38' ' ' LEU . 2.7 mm? -59.8 -42.21 92.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.802 -178.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -82.42 -21.79 35.58 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.881 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -62.3 -50.89 69.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.556 0.693 . . . . 0.0 110.067 175.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -112.83 36.03 3.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.586 -177.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 43' ' ' GLU . 7.3 pt-20 -52.15 -40.54 61.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.464 -175.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.438 ' N ' ' HG3' ' A' ' 42' ' ' GLU . 15.2 tp10 -85.49 -13.17 49.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.078 0.466 . . . . 0.0 111.058 -173.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.3 t -99.07 -38.25 6.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.112 0.482 . . . . 0.0 110.754 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.8 mt -83.13 150.18 4.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.648 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -124.23 165.52 17.48 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 173.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -60.43 -40.06 89.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.073 0.463 . . . . 0.0 111.502 -175.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.464 ' HD3' ' HA ' ' A' ' 48' ' ' LYS . 68.1 mmtt -73.03 -31.85 64.71 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.579 -178.199 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.537 ' HE3' ' HA ' ' A' ' 92' ' ' ARG . 54.4 ttm -54.41 -43.77 71.78 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.897 0.379 . . . . 0.0 110.193 171.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.11 -44.19 94.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.751 178.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.501 ' HA ' ' HB2' ' A' ' 54' ' ' LEU . 41.2 mt-10 -70.97 -38.45 72.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.759 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -66.57 -23.98 66.28 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.034 0.445 . . . . 0.0 111.372 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.4 m -120.54 25.68 9.62 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.25 176.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.542 ' HG ' ' HE3' ' A' ' 24' ' ' MET . 51.4 tp -61.58 -34.28 75.32 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.423 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -67.34 -33.49 75.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.031 176.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.429 ' HD3' ' HA ' ' A' ' 56' ' ' LYS . 54.4 mmtt -74.6 -43.77 53.95 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.511 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.84 -37.9 80.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.954 0.407 . . . . 0.0 109.989 175.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -74.98 -39.21 61.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.337 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.449 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 40.8 tt0 -63.25 -32.06 73.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.304 0.573 . . . . 0.0 109.858 176.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.486 ' HE1' ' C ' ' A' ' 85' ' ' PRO . 69.0 t80 -63.76 -54.88 28.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.408 178.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 21.5 pt -65.51 -28.91 45.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.936 -174.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.449 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 9.4 pt-20 -78.23 -37.03 46.25 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.044 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -86.33 113.49 22.36 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.693 0.282 . . . . 0.0 111.67 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.462 ' HB2' ' HD3' ' A' ' 85' ' ' PRO . 11.5 m 53.55 62.13 2.79 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.597 173.22 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -63.49 -27.13 69.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 122.177 0.989 . . . . 0.0 108.777 173.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.3 p30 -138.52 -157.28 0.76 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.272 -1.331 . . . . 0.0 108.188 173.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.6 p -151.25 153.41 34.82 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 170.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 t -65.1 -29.87 70.77 Favored 'General case' 0 C--N 1.313 -1.014 0 O-C-N 123.782 0.677 . . . . 0.0 110.373 -170.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -55.79 -36.12 67.05 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.978 178.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.2 p -103.72 -6.71 21.26 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.57 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -105.27 168.44 9.07 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -95.05 -13.01 25.56 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -76.0 114.73 14.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.343 178.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -87.41 -22.55 24.94 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 175.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -75.84 75.76 2.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.897 178.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 38.4 t -163.55 133.91 4.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.766 178.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -116.29 77.78 1.13 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.029 0.442 . . . . 0.0 111.036 -175.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -72.25 136.58 46.37 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.358 172.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 46.9 tp -62.84 -67.45 0.42 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.467 ' HB3' ' CD2' ' A' ' 83' ' ' TYR . 6.0 mp -88.08 90.71 8.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.742 170.051 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -83.0 144.84 29.68 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.86 -7.8 78.82 Favored Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -169.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.467 ' CD2' ' HB3' ' A' ' 80' ' ' LEU . 46.1 m-85 -126.07 164.05 21.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.578 -0.311 . . . . 0.0 110.334 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -128.51 154.23 79.4 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 169.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.542 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 71.8 Cg_endo -80.14 165.79 21.2 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.467 2.111 . . . . 0.0 112.167 177.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -152.69 147.22 25.85 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 173.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -78.52 140.6 38.54 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.447 177.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.9 m -137.81 141.05 39.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.579 173.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.5 p -89.17 129.69 39.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.171 0.51 . . . . 0.0 111.168 -178.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -132.3 96.08 3.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.736 175.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.52 -113.8 4.6 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.753 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.537 ' HA ' ' HE3' ' A' ' 49' ' ' MET . 29.4 mmt180 -111.61 14.09 21.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.113 0.483 . . . . 0.0 110.321 177.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 48.3 t -123.98 148.05 47.27 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.276 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 89.4 mt -110.63 125.94 67.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.032 178.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -109.68 174.78 5.71 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.881 -175.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.425 HD11 ' O ' ' A' ' 56' ' ' LYS . 58.0 mt -126.38 105.74 14.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.625 -176.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.542 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 17.4 mm-40 -95.93 -173.88 2.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.877 178.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -135.61 143.77 45.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.037 0.446 . . . . 0.0 111.098 179.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -129.71 155.95 45.07 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 173.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -71.79 137.47 47.66 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.831 0.348 . . . . 0.0 110.598 -178.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.565 ' SG ' HG11 ' A' ' 103' ' ' VAL . 43.9 t -55.82 122.83 48.96 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.108 178.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -71.02 -7.77 22.15 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.956 2.437 . . . . 0.0 113.536 -175.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.565 HG11 ' SG ' ' A' ' 101' ' ' CYS . 3.8 p -69.67 -19.67 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.009 0.433 . . . . 0.0 110.429 178.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -65.78 -25.33 67.21 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 45.9 mmm-85 -97.25 86.54 3.94 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.57 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.312 -1.026 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.651 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.454 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 24.9 mmt . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -114.94 87.53 15.3 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.963 -176.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.454 ' HD3' ' O ' ' A' ' 1' ' ' MET . 4.4 Cg_exo -73.78 78.19 2.51 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.538 2.159 . . . . 0.0 111.229 175.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 59.3 mt -90.02 -52.54 10.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.084 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -135.58 88.0 0.24 Allowed Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.016 -176.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.441 ' O ' ' HG3' ' A' ' 6' ' ' ARG . 11.6 ptp180 -77.07 101.61 6.15 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 173.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 p -111.87 29.3 7.99 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.688 -173.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 92.7 mt -78.05 -30.23 49.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.288 0.566 . . . . 0.0 110.259 178.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -104.46 112.44 25.5 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.155 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.92 -167.11 41.66 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.822 176.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.7 t -81.68 92.6 2.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.204 0.526 . . . . 0.0 109.867 178.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.5 p -104.74 88.71 2.98 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.057 176.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.568 ' C ' ' HD2' ' A' ' 14' ' ' ARG . . . 80.81 -167.46 50.03 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.637 -176.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.568 ' HD2' ' C ' ' A' ' 13' ' ' GLY . 7.6 mpt_? -141.65 76.22 20.78 Favored Pre-proline 0 C--N 1.324 -0.528 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.523 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 71.9 Cg_endo -76.01 64.13 6.88 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.74 2.293 . . . . 0.0 112.367 176.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.602 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -66.92 -29.06 68.84 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.951 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -59.14 -50.0 75.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.83 0.348 . . . . 0.0 110.063 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.523 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -71.07 -29.25 65.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.161 -179.096 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.407 ' HE3' ' HB3' ' A' ' 19' ' ' LYS . 24.3 mtpp -63.24 -49.07 75.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.405 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.602 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 20.5 mtm105 -69.03 -40.76 78.44 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 121.456 0.646 . . . . 0.0 109.449 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 34.1 tp -54.54 -49.29 70.64 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.491 -1.231 . . . . 0.0 111.212 177.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -75.45 -28.32 59.25 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.638 177.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.409 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 8.6 tp-100 -62.0 -52.64 63.18 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.764 ' HE2' ' HG ' ' A' ' 54' ' ' LEU . 25.2 ptm -66.3 -36.43 82.94 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.407 177.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.427 ' HG3' ' HE3' ' A' ' 29' ' ' MET . 4.7 tppp? -55.3 -50.0 70.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.942 0.401 . . . . 0.0 110.487 175.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -58.04 -47.04 84.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.503 178.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.43 ' HB3' ' HE3' ' A' ' 27' ' ' LYS . 25.9 mtpp -59.8 -42.67 93.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.811 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.612 HG13 HG11 ' A' ' 34' ' ' VAL . 84.5 t -67.81 -36.48 75.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.076 -176.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.427 ' HE3' ' HG3' ' A' ' 25' ' ' LYS . 23.4 ptp -82.65 -0.92 49.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.179 0.514 . . . . 0.0 110.387 178.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.5 tptt -91.61 -12.17 35.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.294 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.446 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 24.9 t70 -85.48 136.97 33.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.193 -176.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.96 -47.03 75.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.652 -177.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -63.52 -45.37 90.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.036 0.446 . . . . 0.0 110.444 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.612 HG11 HG13 ' A' ' 28' ' ' VAL . 49.7 t -56.41 -56.4 13.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.824 -179.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.514 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.2 pt20 -66.13 -29.95 70.35 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -176.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.62 -40.75 97.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.016 0.436 . . . . 0.0 109.932 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.474 ' CE2' HD12 ' A' ' 45' ' ' ILE . 93.1 t80 -70.23 -36.34 74.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.95 177.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.431 HD11 ' HA ' ' A' ' 38' ' ' LEU . 1.4 mm? -56.84 -49.46 75.37 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.412 178.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 35' ' ' GLN . 5.2 ptpp? -77.7 -21.33 52.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.237 0.542 . . . . 0.0 110.624 -178.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.81 -60.72 2.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.327 174.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -102.48 33.85 3.0 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.737 -174.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -61.62 -20.64 63.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.417 178.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -85.89 -16.06 39.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.807 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 41.3 t -109.94 -42.46 5.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.854 0.359 . . . . 0.0 111.591 -173.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.474 HD12 ' CE2' ' A' ' 37' ' ' PHE . 56.3 mt -78.43 144.0 11.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.668 -175.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -106.73 165.39 11.34 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.739 175.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -58.04 -45.15 87.45 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.925 0.393 . . . . 0.0 111.023 176.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.577 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 14.1 mmmm -67.01 -37.35 84.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.708 0.766 . . . . 0.0 110.323 -178.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.437 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 19.1 ttt -57.2 -37.61 72.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.296 176.091 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 28.3 mm -63.73 -54.61 29.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.404 178.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.577 ' OE2' ' HE2' ' A' ' 48' ' ' LYS . 2.0 pp20? -63.1 -43.88 97.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.086 0.469 . . . . 0.0 111.414 -178.155 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.569 ' HE2' ' HA ' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -57.3 -31.91 66.12 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.839 178.124 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 73.3 p -108.92 14.26 24.26 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.457 -178.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.764 ' HG ' ' HE2' ' A' ' 24' ' ' MET . 51.8 tp -59.05 -34.45 71.95 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.928 0.394 . . . . 0.0 110.645 -179.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -66.91 -38.25 85.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.754 176.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.47 ' O ' HD13 ' A' ' 96' ' ' ILE . 27.8 mmmt -66.04 -47.97 72.6 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.058 0.456 . . . . 0.0 109.944 176.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.773 ' HG ' HD21 ' A' ' 87' ' ' LEU . 11.0 mp -64.64 -35.88 82.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.308 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -69.34 -43.05 74.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.73 0.3 . . . . 0.0 110.247 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.493 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 9.2 tp10 -58.66 -37.19 75.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.815 0.817 . . . . 0.0 109.801 174.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.479 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 87.9 t80 -61.83 -47.85 83.2 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.581 -1.19 . . . . 0.0 111.689 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.538 HD12 ' HA ' ' A' ' 28' ' ' VAL . 29.8 pt -76.36 -30.54 19.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -177.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.493 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 10.1 pt-20 -79.85 -20.09 46.82 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.466 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 10.1 pt20 -82.29 175.8 9.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.862 0.363 . . . . 0.0 110.206 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.1 m -68.35 102.88 1.49 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.102 0.477 . . . . 0.0 110.963 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -69.62 -31.15 69.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.282 177.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -93.76 -165.77 1.38 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.049 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -157.58 162.66 38.77 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.042 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.496 ' HA ' ' O ' ' A' ' 71' ' ' SER . 8.0 p -69.32 -18.93 63.87 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 123.48 0.487 . . . . 0.0 111.908 -174.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -77.83 4.98 10.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.109 0.48 . . . . 0.0 110.946 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 26.1 p -145.51 -44.51 0.21 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.712 175.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.496 ' O ' ' HA ' ' A' ' 68' ' ' SER . 2.5 m -105.32 125.37 50.91 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.215 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -87.44 11.02 15.66 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.011 0.434 . . . . 0.0 111.232 -177.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.65 115.16 3.42 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.924 177.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -86.52 -5.3 59.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.679 176.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -60.95 -47.58 85.8 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.9 -177.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 19.0 p -101.28 143.73 30.99 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.8 -176.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -94.95 104.55 16.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.06 0.457 . . . . 0.0 110.238 176.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.33 103.34 11.03 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 174.209 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.6 tp -52.53 -61.95 1.95 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.727 -177.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.587 ' HB3' ' HB2' ' A' ' 83' ' ' TYR . 4.5 mm? -84.89 87.38 7.34 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.28 128.52 36.52 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.561 0.696 . . . . 0.0 110.785 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.25 -9.66 65.2 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.354 -175.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.587 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . 37.0 m-85 -117.39 168.39 10.4 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 122.473 0.309 . . . . 0.0 110.517 178.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.412 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 12.2 m170 -131.83 148.22 69.05 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.543 172.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -76.63 136.73 17.49 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.211 1.94 . . . . 0.0 111.577 176.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.458 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 40.3 ttpt -136.86 135.72 38.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.08 0.467 . . . . 0.0 110.191 177.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.773 HD21 ' HG ' ' A' ' 57' ' ' LEU . 1.0 OUTLIER -67.65 130.42 42.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.369 177.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.5 m -130.51 148.62 33.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 120.939 0.4 . . . . 0.0 110.88 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.7 p -97.64 115.08 36.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 173.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -117.89 96.17 5.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.447 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 63.56 -100.61 0.38 Allowed Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.481 -0.782 . . . . 0.0 112.827 177.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -112.18 15.16 20.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.144 0.497 . . . . 0.0 111.758 -176.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.1 p -143.85 149.02 36.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.681 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 62.6 mt -98.78 132.66 43.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 174.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -132.9 178.3 6.98 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.051 0.453 . . . . 0.0 110.699 -171.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.47 HD13 ' O ' ' A' ' 56' ' ' LYS . 40.7 mt -119.62 113.96 42.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.329 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -105.23 178.52 4.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.163 176.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.516 ' CE1' ' HB2' ' A' ' 80' ' ' LEU . 16.3 m-85 -127.59 129.16 46.8 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.636 179.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.458 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 54.0 p90 -113.17 150.78 31.76 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 174.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -65.21 129.96 41.61 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.403 -178.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 36.1 t -45.19 122.5 5.11 Favored Pre-proline 0 N--CA 1.463 0.21 0 O-C-N 123.409 0.443 . . . . 0.0 109.81 173.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.47 -30.09 86.95 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.856 2.371 . . . . 0.0 111.867 -177.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 16.9 t -66.63 -25.35 34.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.355 -178.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -61.49 -33.35 73.64 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.465 -174.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.18 13.49 3.89 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.751 177.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 95.3 mttt . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 114.756 -1.111 . . . . 0.0 112.441 177.317 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.609 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 1.3 mpt? . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.987 0.422 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -107.47 88.91 4.47 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.807 -177.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.609 ' HD3' ' O ' ' A' ' 1' ' ' MET . 2.9 Cg_exo -73.96 65.0 5.08 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.935 2.423 . . . . 0.0 112.765 -175.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 61.8 mt -94.37 100.74 11.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -120.46 101.18 0.8 Allowed Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.132 -173.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 25.5 mtp85 -96.0 34.22 1.58 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.0 0.428 . . . . 0.0 109.955 172.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.2 p -63.76 107.58 1.23 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.964 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 87.9 mt -95.1 6.09 50.02 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.108 179.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -114.36 120.23 39.64 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.608 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.13 165.49 43.35 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.173 179.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.507 HG11 ' HD2' ' A' ' 15' ' ' PRO . 46.4 t -84.45 93.87 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.052 0.454 . . . . 0.0 110.269 178.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 m -87.88 104.2 16.38 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.393 177.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.488 ' O ' ' HD2' ' A' ' 14' ' ' ARG . . . 74.71 -118.32 5.71 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -173.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.488 ' HD2' ' O ' ' A' ' 13' ' ' GLY . 16.3 mmm180 -143.08 76.37 16.7 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-O 120.898 0.38 . . . . 0.0 110.683 175.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.507 ' HD2' HG11 ' A' ' 11' ' ' VAL . 72.8 Cg_endo -78.79 62.94 8.53 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.388 2.059 . . . . 0.0 111.521 173.455 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -72.51 -23.67 61.05 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.526 -178.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -64.46 -48.26 75.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.67 178.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -70.71 -32.8 70.14 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 -178.506 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HE3' ' HB3' ' A' ' 19' ' ' LYS . 9.1 mmmt -57.74 -55.69 31.65 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.771 177.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.413 ' HA ' ' HB2' ' A' ' 23' ' ' GLN . 7.4 ptm85 -69.36 -25.73 64.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.381 -176.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.7 tp -68.74 -50.7 48.5 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.964 0.411 . . . . 0.0 111.0 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -73.05 -30.75 63.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.462 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.413 ' HB2' ' HA ' ' A' ' 20' ' ' ARG . 8.2 mt-30 -60.24 -57.0 14.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.768 178.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.434 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.6 ptm -57.51 -43.11 83.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.095 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.8 tptp -63.07 -39.58 95.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.748 0.309 . . . . 0.0 110.808 177.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -61.61 -50.72 71.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.582 178.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -56.27 -48.57 76.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.012 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 24' ' ' MET . 89.1 t -60.43 -43.0 93.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.101 0.477 . . . . 0.0 110.569 -179.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.6 mtp -86.26 13.92 7.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.143 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -110.66 -34.04 6.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.98 0.419 . . . . 0.0 110.555 177.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.68 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 25.2 t70 -59.58 127.22 30.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.282 -174.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -69.59 -25.4 63.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.44 -174.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -83.04 -35.96 25.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.409 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.2 t -57.43 -47.13 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.875 0.369 . . . . 0.0 110.46 171.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.68 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 47.8 mt-30 -65.24 -36.65 84.81 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.319 0.581 . . . . 0.0 110.434 179.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.55 -39.99 93.09 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.333 175.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.529 ' CD2' HD23 ' A' ' 87' ' ' LEU . 58.0 t80 -66.07 -40.66 91.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.792 176.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 38' ' ' LEU . 2.1 mm? -59.79 -42.01 92.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.291 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -80.63 -24.11 39.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.118 0.485 . . . . 0.0 110.655 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.04 -53.24 52.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.556 0.693 . . . . 0.0 110.124 178.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -113.94 31.93 6.21 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.462 -173.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.433 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 9.8 pt-20 -62.91 -18.86 63.61 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.573 -178.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -77.71 -27.92 50.78 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.491 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 37.9 t -103.75 -37.18 4.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.55 -173.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.465 HD11 ' CZ ' ' A' ' 37' ' ' PHE . 74.0 mt -80.03 148.43 5.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.681 -174.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -130.06 174.5 9.73 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 174.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -59.24 -44.55 92.35 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 -175.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -67.17 -36.52 81.95 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.965 0.412 . . . . 0.0 111.149 -175.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 46.7 ttm -58.18 -38.0 75.83 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.842 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.2 mm -68.18 -48.48 73.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.622 176.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -53.47 -48.77 68.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.161 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.618 ' N ' ' HE2' ' A' ' 52' ' ' LYS . 0.8 OUTLIER -65.76 -43.25 89.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 -178.353 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.416 ' O ' HD12 ' A' ' 57' ' ' LEU . 8.3 m -89.95 13.02 15.75 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.189 -173.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.92 -33.9 69.27 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.028 0.442 . . . . 0.0 110.668 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -70.29 -37.44 74.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.585 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.446 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.6 mmmt -69.16 -42.62 75.66 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 120.911 0.386 . . . . 0.0 110.398 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.872 ' HG ' HD22 ' A' ' 87' ' ' LEU . 9.6 mp -61.78 -40.72 96.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.996 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -69.21 -44.37 72.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.104 0.478 . . . . 0.0 110.238 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -54.23 -45.85 72.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.778 174.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.435 ' CG ' HD11 ' A' ' 87' ' ' LEU . 32.9 t80 -60.25 -50.81 72.19 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.846 -1.07 . . . . 0.0 112.768 -178.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.467 ' O ' ' HE2' ' A' ' 65' ' ' LYS . 29.8 pt -64.82 -30.28 49.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -173.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.415 ' HG2' HG13 ' A' ' 61' ' ' ILE . 6.7 mm-40 -90.01 -29.69 18.26 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.27 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.421 HE21 ' HA ' ' A' ' 60' ' ' TYR . 22.5 pt20 -85.87 133.13 33.98 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.686 -176.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.474 ' HB3' ' HG3' ' A' ' 85' ' ' PRO . 15.2 t 49.7 40.12 19.22 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.287 0.565 . . . . 0.0 112.254 168.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.467 ' HE2' ' O ' ' A' ' 61' ' ' ILE . 11.8 ptpt -63.85 -24.32 67.7 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.302 0.572 . . . . 0.0 110.203 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.525 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 34.1 p30 -130.82 -170.35 2.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.026 171.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.0 p -152.58 164.1 38.31 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 176.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.529 ' HB3' ' OE2' ' A' ' 81' ' ' GLU . 31.0 t -63.48 -37.01 85.65 Favored 'General case' 0 C--N 1.317 -0.805 0 O-C-N 123.294 0.371 . . . . 0.0 110.973 -170.089 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.64 ' CZ ' ' HG3' ' A' ' 104' ' ' LYS . 2.6 t80 -55.56 -21.99 19.77 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.246 0.618 . . . . 0.0 111.935 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.5 p -124.28 11.57 8.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.159 0.504 . . . . 0.0 110.204 -179.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.5 t -104.68 121.25 43.19 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.806 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -84.05 -21.9 31.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.805 178.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.03 137.82 32.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.291 174.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -83.72 -21.23 32.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.116 -176.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -100.27 27.95 5.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.052 0.453 . . . . 0.0 111.082 -172.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 31.7 t -80.65 149.94 29.62 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -102.1 112.04 24.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.862 0.363 . . . . 0.0 111.688 -176.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -176.27 149.15 0.82 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.609 173.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.5 mp -100.32 -41.72 6.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.184 0.516 . . . . 0.0 110.49 -177.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.422 ' HG ' ' CE2' ' A' ' 98' ' ' TYR . 3.1 mm? -72.45 112.01 8.14 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.381 -177.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.529 ' OE2' ' HB3' ' A' ' 68' ' ' SER . 4.9 tp10 -95.33 138.74 32.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.148 176.074 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 78.05 -7.66 42.68 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.367 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -125.6 153.75 43.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 117.237 0.519 . . . . 0.0 111.2 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.525 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 13.1 m170 -129.5 157.51 76.18 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 168.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.474 ' HG3' ' HB3' ' A' ' 64' ' ' SER . 73.0 Cg_endo -80.21 148.53 19.07 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.526 2.151 . . . . 0.0 111.213 176.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.617 ' HB2' ' CD1' ' A' ' 99' ' ' TYR . 20.7 ttpp -137.8 144.11 41.38 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.081 0.467 . . . . 0.0 109.874 175.332 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.872 HD22 ' HG ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -68.69 128.68 37.53 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.744 176.137 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 15.6 m -128.02 145.57 34.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.067 179.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 10.8 p -103.69 115.86 46.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.646 0.736 . . . . 0.0 109.881 174.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -114.71 95.51 5.27 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.274 179.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.53 -115.08 6.08 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.876 -176.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -107.05 18.61 21.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.069 0.461 . . . . 0.0 111.02 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.0 m -131.05 143.2 50.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.821 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 77.1 mt -102.18 124.15 55.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -121.62 178.33 4.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -175.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.446 HD11 ' O ' ' A' ' 56' ' ' LYS . 54.2 mt -125.02 112.57 32.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.707 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -126.93 158.21 37.42 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.422 ' CE2' ' HG ' ' A' ' 80' ' ' LEU . 12.9 m-85 -97.24 158.28 15.53 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -166.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.617 ' CD1' ' HB2' ' A' ' 86' ' ' LYS . 55.3 p90 -139.6 160.92 38.76 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.356 175.302 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -72.32 129.42 38.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.082 0.468 . . . . 0.0 111.586 -179.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 44.0 t -46.88 122.02 7.13 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.607 172.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.89 -22.26 49.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.648 2.232 . . . . 0.0 112.258 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.8 t -68.06 -15.96 20.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.951 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.64 ' HG3' ' CZ ' ' A' ' 69' ' ' TYR . 28.3 tttm -70.01 -21.1 63.24 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.167 0.508 . . . . 0.0 110.263 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 -83.21 39.14 0.64 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.16 -176.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 50.4 tptt . . . . . 0 N--CA 1.442 -0.865 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.721 -178.472 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 tpt . . . . . 0 N--CA 1.477 0.914 0 CA-C-O 120.92 0.391 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -122.81 148.04 52.61 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.537 176.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.85 146.32 79.29 Favored 'Trans proline' 0 CA--C 1.53 0.302 0 C-N-CA 122.965 2.443 . . . . 0.0 112.516 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pp -81.38 165.17 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-O 120.935 0.398 . . . . 0.0 111.567 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -89.16 134.46 12.41 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.379 178.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -153.95 141.33 19.67 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.2 m -81.79 98.33 8.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.823 0.344 . . . . 0.0 110.791 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -91.24 76.39 6.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.058 0.456 . . . . 0.0 110.319 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -101.69 -27.49 13.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.906 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.96 153.12 28.08 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.277 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 6.4 m -74.59 93.85 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.701 0.762 . . . . 0.0 110.775 178.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.1 p -76.35 92.33 3.34 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.647 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 133.95 83.35 0.2 Allowed Glycine 0 N--CA 1.442 -0.956 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.985 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.534 ' HG2' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -144.32 75.57 15.17 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-O 121.717 0.77 . . . . 0.0 109.835 175.638 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.794 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 33.7 Cg_endo -66.3 144.75 75.56 Favored 'Trans proline' 0 C--O 1.234 0.314 0 C-N-CA 122.58 2.187 . . . . 0.0 112.27 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.584 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 1.5 m-20 -58.64 -37.33 75.71 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.669 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -49.5 -57.1 7.67 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.467 -178.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.794 ' HG2' ' HG2' ' A' ' 15' ' ' PRO . 1.5 pt20 -67.59 -29.65 69.05 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.463 -175.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.697 ' HE2' ' HA ' ' A' ' 19' ' ' LYS . 9.5 mmpt? -68.04 -37.72 81.67 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.864 -0.335 . . . . 0.0 111.296 -178.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.584 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 54.3 mtt180 -70.34 -40.7 73.96 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.646 0.736 . . . . 0.0 109.051 174.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.6 tp -57.11 -49.31 76.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.232 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 11.0 mm-40 -66.14 -30.56 71.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.15 0.5 . . . . 0.0 110.536 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.473 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 22.5 tt0 -70.12 -53.21 18.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.794 -176.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.471 ' HE3' HD21 ' A' ' 54' ' ' LEU . 25.8 ptm -67.82 -36.33 80.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.633 178.595 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' HG3' ' HE2' ' A' ' 29' ' ' MET . 23.9 tptm -58.13 -42.39 85.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.16 0.505 . . . . 0.0 109.841 175.546 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.437 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 3.7 tp10 -62.58 -49.31 75.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.961 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -54.51 -48.78 71.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.352 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.456 HG23 ' O ' ' A' ' 24' ' ' MET . 92.3 t -61.12 -45.18 99.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.128 -178.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.47 ' HE2' ' HG3' ' A' ' 25' ' ' LYS . 16.7 ptp -82.64 3.4 29.05 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.417 -176.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 13.9 mptt -106.13 -6.13 18.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.688 0.28 . . . . 0.0 110.957 177.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.682 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 15.2 t70 -85.63 129.48 34.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.676 0.274 . . . . 0.0 110.504 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -65.12 -36.74 85.22 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.466 -174.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.43 -38.95 68.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.979 -176.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.4 t -55.75 -49.97 70.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.518 174.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 57.0 mt-30 -61.67 -41.02 96.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.899 -178.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.711 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . . . -57.39 -42.1 81.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.72 176.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.487 ' CG ' ' HB3' ' A' ' 87' ' ' LEU . 54.6 t80 -69.62 -39.91 76.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.321 177.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 38' ' ' LEU . 1.7 mm? -57.3 -43.28 83.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.41 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.711 ' HE2' ' HA ' ' A' ' 36' ' ' ALA . 52.6 pttt -83.94 -17.76 39.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 111.121 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.83 -52.99 37.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.102 174.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -111.33 33.05 4.9 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.721 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.66 -33.14 63.82 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -175.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -82.09 -23.63 35.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.034 0.445 . . . . 0.0 111.128 -177.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.7 t -91.81 -41.88 13.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.193 0.521 . . . . 0.0 110.593 -175.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.408 HD11 ' CE2' ' A' ' 37' ' ' PHE . 74.1 mt -73.13 146.67 10.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.549 -178.521 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -120.72 161.29 21.68 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -60.61 -37.85 82.75 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.919 176.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.553 ' O ' ' HG2' ' A' ' 52' ' ' LYS . 13.3 mmmm -63.64 -37.54 87.71 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.172 175.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.537 ' HG2' HG13 ' A' ' 94' ' ' ILE . 46.6 ttm -64.0 -32.38 73.91 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.454 177.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.427 HD11 HD11 ' A' ' 38' ' ' LEU . 35.5 mm -62.3 -54.44 34.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.331 -179.511 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.472 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 2.0 pt-20 -60.81 -47.1 87.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.842 0.353 . . . . 0.0 111.757 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' A' ' 48' ' ' LYS . 74.4 mmtt -55.87 -48.08 76.2 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.383 0.611 . . . . 0.0 110.536 178.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.518 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.4 m -94.37 13.61 23.13 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.565 -173.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -54.44 -47.85 72.4 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.537 0.684 . . . . 0.0 110.265 178.81 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -56.22 -40.84 74.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.735 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.513 ' O ' HD13 ' A' ' 96' ' ' ILE . 13.6 mmmm -70.18 -44.04 69.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.994 -179.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 53' ' ' SER . 75.1 mt -62.74 -38.88 92.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.24 0.543 . . . . 0.0 110.187 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -69.74 -41.43 75.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.249 177.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.06 -37.78 80.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.012 0.434 . . . . 0.0 110.511 176.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.461 ' CD1' HD11 ' A' ' 87' ' ' LEU . 89.1 t80 -56.38 -50.51 71.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.105 177.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.2 pt -75.49 -29.71 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.812 -178.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -66.42 -46.75 75.46 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.517 177.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -65.81 -175.16 0.27 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.85 -0.613 . . . . 0.0 112.11 -177.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.782 ' HB3' ' HA ' ' A' ' 78' ' ' ASN . 2.9 p -59.92 102.6 0.16 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.193 179.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -68.88 -33.1 73.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.469 0.652 . . . . 0.0 110.349 -178.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -124.94 -156.2 0.71 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 173.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.665 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -148.53 152.1 36.26 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 119.659 -0.816 . . . . 0.0 109.843 174.536 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.645 ' HA ' ' O ' ' A' ' 71' ' ' SER . 0.7 OUTLIER -74.68 -23.34 58.61 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.405 -169.951 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -58.26 -20.65 43.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.153 176.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.3 p -118.27 -47.05 2.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.967 0.413 . . . . 0.0 110.862 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.645 ' O ' ' HA ' ' A' ' 68' ' ' SER . 8.6 m -100.85 118.37 36.77 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.722 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -83.44 56.57 3.63 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.755 0.788 . . . . 0.0 110.18 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -85.43 122.58 29.78 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.939 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -75.74 -15.43 60.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.037 -173.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -119.15 -2.73 10.68 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -174.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 44.7 t -73.18 114.11 11.0 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.893 0.378 . . . . 0.0 110.433 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -77.31 115.59 17.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.886 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.782 ' HA ' ' HB3' ' A' ' 64' ' ' SER . 10.6 m-80 -111.34 132.46 54.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.401 -176.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.415 HD21 ' N ' ' A' ' 79' ' ' LEU . 3.1 mm? -89.6 -79.25 0.34 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.811 -0.632 . . . . 0.0 109.331 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.446 ' HB3' ' HD2' ' A' ' 83' ' ' TYR . 7.2 mp -87.35 88.39 7.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.062 175.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -64.27 144.4 57.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.66 -179.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.21 -8.1 72.46 Favored Glycine 0 N--CA 1.445 -0.752 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.201 -177.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.446 ' HD2' ' HB3' ' A' ' 80' ' ' LEU . 61.2 m-85 -121.58 167.34 13.0 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 178.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -131.85 145.69 58.58 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 172.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -79.67 135.29 11.46 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.414 2.076 . . . . 0.0 111.709 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.639 ' HB2' ' HZ3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -125.66 139.68 53.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.309 0.576 . . . . 0.0 109.784 173.662 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.487 ' HB3' ' CG ' ' A' ' 37' ' ' PHE . 1.1 tp -77.39 131.52 38.08 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.054 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.437 ' CG2' ' HB3' ' A' ' 95' ' ' ASP . 30.0 m -136.31 170.0 19.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.3 p -112.92 114.52 47.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.368 0.604 . . . . 0.0 110.27 175.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -121.14 107.96 13.22 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.644 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.26 -112.47 3.65 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.396 -178.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.419 ' HA ' ' HD3' ' A' ' 92' ' ' ARG . 30.7 mmt180 -117.92 12.01 13.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.167 0.508 . . . . 0.0 109.932 177.474 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 38.1 p -128.36 150.79 49.94 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.078 -177.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.537 HG13 ' HG2' ' A' ' 49' ' ' MET . 77.9 mt -86.38 131.91 33.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 176.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.437 ' HB3' ' CG2' ' A' ' 88' ' ' VAL . 13.6 t0 -119.5 169.26 10.2 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.932 -170.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.513 HD13 ' O ' ' A' ' 56' ' ' LYS . 60.5 mt -126.86 113.93 35.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.908 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -118.14 159.93 22.43 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 175.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -108.84 129.0 55.39 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.176 0.513 . . . . 0.0 111.527 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 45.8 p90 -108.69 153.84 22.87 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -73.41 135.54 44.21 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.541 -176.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.55 ' SG ' HG12 ' A' ' 103' ' ' VAL . 47.7 t -45.3 126.3 5.86 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.802 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.51 -13.65 22.05 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.364 2.709 . . . . 0.0 113.885 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.55 HG12 ' SG ' ' A' ' 101' ' ' CYS . 9.9 p -66.9 -23.08 30.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 121.041 0.448 . . . . 0.0 110.348 178.213 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 9.0 mmmm -65.83 -28.96 69.37 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.578 0.704 . . . . 0.0 109.85 174.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 105' ' ' ARG . 4.1 mmp_? -104.58 14.57 29.67 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.176 178.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 63.8 pttt . . . . . 0 N--CA 1.466 0.356 0 CA-C-N 114.207 -1.36 . . . . 0.0 112.113 -175.441 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.1 ttt . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 120.744 0.306 . . . . 0.0 110.689 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.406 ' H ' ' CD ' ' A' ' 2' ' ' GLU . 1.2 pm0 -72.4 147.64 90.2 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 175.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.91 99.04 0.38 Allowed 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.498 2.132 . . . . 0.0 112.903 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 39.5 mm -87.98 76.36 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -135.07 117.57 1.76 Allowed Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.761 -175.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -123.97 2.48 8.69 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.283 0.563 . . . . 0.0 109.826 174.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.2 m -86.73 14.17 7.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.914 -177.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.5 mp -67.15 -40.63 86.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.704 -179.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 81.2 mm-40 -129.86 -61.15 1.01 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.373 0.606 . . . . 0.0 110.395 -179.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.36 -96.6 0.19 Allowed Glycine 0 N--CA 1.446 -0.688 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.209 -177.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.4 t -103.98 94.51 3.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.121 0.486 . . . . 0.0 109.916 177.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.0 t -164.29 154.27 14.39 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.229 178.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.449 ' O ' ' HD3' ' A' ' 14' ' ' ARG . . . 76.4 104.13 0.14 Allowed Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.89 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.449 ' HD3' ' O ' ' A' ' 13' ' ' GLY . 57.9 mmt-85 -142.25 67.88 21.39 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-O 120.924 0.392 . . . . 0.0 110.38 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.614 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 71.9 Cg_endo -84.0 103.5 1.01 Allowed 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.336 2.024 . . . . 0.0 111.138 174.403 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.68 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -65.47 -21.37 66.63 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 121.034 -0.266 . . . . 0.0 110.635 -175.725 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -55.96 -50.95 69.38 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.332 175.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.614 ' HG2' ' HG2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -69.04 -30.67 69.08 Favored 'General case' 0 C--O 1.226 -0.179 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -178.781 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 29.5 mmmt -60.33 -47.74 84.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.354 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.68 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 14.0 mtm-85 -71.06 -53.31 15.15 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.1 -51.11 70.61 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.506 -174.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -75.98 -28.28 57.78 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 -176.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 8.9 tt0 -64.45 -55.84 18.2 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.079 176.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.56 ' O ' HG23 ' A' ' 28' ' ' VAL . 27.6 ptm -62.0 -40.78 96.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.72 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HA ' HD23 ' A' ' 54' ' ' LEU . 80.8 tttt -62.8 -42.58 99.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.43 -178.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.476 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 14.3 tt0 -62.68 -45.97 90.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.864 0.364 . . . . 0.0 110.106 177.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.0 mtpt -55.46 -45.21 76.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.456 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 24' ' ' MET . 72.1 t -61.77 -42.42 94.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.678 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.419 ' HE2' ' HG2' ' A' ' 25' ' ' LYS . 21.8 ptp -84.77 14.61 4.57 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.29 -177.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 2.4 mptm? -115.25 -14.83 11.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.059 176.092 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.628 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 19.6 t70 -74.16 135.33 42.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.069 0.461 . . . . 0.0 110.662 -177.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -66.72 -36.67 83.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.965 -175.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -75.3 -35.86 61.22 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.017 0.437 . . . . 0.0 110.065 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.1 t -59.66 -41.01 83.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.487 174.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.628 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 74.1 mm-40 -57.15 -49.03 77.2 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.139 0.495 . . . . 0.0 110.04 176.225 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.452 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -56.14 -40.54 73.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.476 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.32 -43.54 85.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.809 0.337 . . . . 0.0 110.981 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.525 HD11 HD13 ' A' ' 50' ' ' ILE . 3.5 mm? -63.02 -43.25 99.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.824 -177.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -70.77 -32.62 69.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.188 0.518 . . . . 0.0 110.721 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -74.36 -29.57 61.62 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.333 -177.727 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -118.27 28.54 8.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.184 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -63.34 -16.95 61.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.608 0.718 . . . . 0.0 109.931 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -73.89 -25.84 60.23 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.908 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.9 t -119.96 -33.73 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -170.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.515 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 73.1 mt -71.8 143.83 13.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.358 0.599 . . . . 0.0 112.203 -172.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -120.1 166.65 13.12 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.91 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -62.52 -41.64 98.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.333 0.587 . . . . 0.0 109.588 174.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -63.89 -37.64 88.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.618 -179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.572 ' HE3' ' HA ' ' A' ' 92' ' ' ARG . 54.0 ttm -58.56 -39.44 80.27 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.551 176.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.525 HD13 HD11 ' A' ' 38' ' ' LEU . 46.6 mm -67.29 -48.31 78.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.742 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -61.78 -37.77 85.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.288 -178.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.471 ' C ' ' HD3' ' A' ' 52' ' ' LYS . 1.1 tmtp? -71.7 -45.99 60.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.386 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 m -92.46 16.55 11.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.452 -173.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -56.52 -40.07 74.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.255 0.55 . . . . 0.0 110.383 178.934 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -62.1 -45.67 92.44 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.462 177.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.457 ' O ' HD12 ' A' ' 96' ' ' ILE . 31.6 mmmt -64.88 -49.57 69.99 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.891 0.377 . . . . 0.0 110.752 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.41 ' CD2' ' HG ' ' A' ' 87' ' ' LEU . 90.0 mt -60.76 -39.12 87.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.886 -178.239 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -69.9 -43.08 72.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.696 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -61.2 -31.74 71.5 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.336 0.589 . . . . 0.0 109.839 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.475 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 34.4 t80 -66.4 -46.23 77.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.189 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 31.2 pt -75.5 -29.01 20.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -176.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -74.23 -35.62 63.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.533 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 10.1 pt20 -75.4 -175.76 2.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.027 0.441 . . . . 0.0 111.016 -178.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.0 t -71.35 93.71 1.16 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.299 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -73.83 -26.98 60.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.29 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -96.09 -172.75 2.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.441 177.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.582 ' HA ' ' ND2' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -141.56 154.21 45.31 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.602 179.573 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.494 ' HA ' ' O ' ' A' ' 71' ' ' SER . 17.5 m -72.4 -11.06 60.53 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.847 -173.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -79.5 -3.56 47.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.093 0.473 . . . . 0.0 110.584 176.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 26.0 p -132.42 -27.55 1.75 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.153 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.494 ' O ' ' HA ' ' A' ' 68' ' ' SER . 19.2 m -114.52 115.8 27.8 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 175.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -76.21 -29.25 57.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -173.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -62.86 131.43 48.76 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.586 0.708 . . . . 0.0 110.98 -169.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -62.99 -22.45 66.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.739 -172.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 -64.77 -22.19 66.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.959 0.409 . . . . 0.0 110.967 -177.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 53.1 m -111.01 25.98 11.19 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.999 -178.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -63.58 143.96 57.4 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.158 0.504 . . . . 0.0 110.641 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.582 ' ND2' ' HA ' ' A' ' 67' ' ' CYS . 0.3 OUTLIER -135.61 139.14 43.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.862 -177.046 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.47 ' HG ' ' N ' ' A' ' 80' ' ' LEU . 2.5 pt? -59.72 -52.26 66.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.216 -179.357 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.518 ' HG ' ' HB2' ' A' ' 83' ' ' TYR . 12.8 tp -86.93 74.74 9.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.304 0.574 . . . . 0.0 109.934 177.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -72.43 146.69 46.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.714 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.56 -8.94 76.64 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.606 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' TYR . . . . . 0.518 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 47.8 m-85 -123.65 164.84 18.27 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.478 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 12.6 m170 -128.33 146.79 61.08 Favored Pre-proline 0 CA--C 1.509 -0.616 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 172.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' PRO . . . . . 0.496 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 56.5 Cg_endo -75.55 138.47 21.78 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.114 1.876 . . . . 0.0 111.064 172.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.413 ' HD2' ' HD1' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -142.3 153.07 43.58 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.082 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.41 ' HG ' ' CD2' ' A' ' 57' ' ' LEU . 2.2 mm? -79.21 147.3 32.66 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.882 0.372 . . . . 0.0 110.517 -177.005 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 25.3 m -131.37 135.63 59.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.633 174.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.1 p -90.38 114.62 28.28 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-O 121.098 0.475 . . . . 0.0 110.832 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -119.38 95.74 4.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.494 178.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.74 -123.93 7.73 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.554 -1.018 . . . . 0.0 110.554 -174.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.572 ' HA ' ' HE3' ' A' ' 49' ' ' MET . 1.5 mpp_? -103.77 10.44 36.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.957 0.408 . . . . 0.0 110.33 173.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 24.8 m -116.11 135.91 53.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 78.1 mt -101.84 133.44 45.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.385 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -118.0 178.6 4.36 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -177.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.457 HD12 ' O ' ' A' ' 56' ' ' LYS . 53.3 mt -127.31 113.39 31.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 120.705 0.288 . . . . 0.0 110.944 -176.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 29.8 mm-40 -113.86 -173.89 2.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.01 179.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.478 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 10.3 m-85 -128.82 150.11 50.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.016 0.436 . . . . 0.0 111.926 -177.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.413 ' HD1' ' HD2' ' A' ' 86' ' ' LYS . 53.3 p90 -136.46 158.13 45.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.088 174.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -71.74 132.59 44.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.376 0.608 . . . . 0.0 111.862 -177.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 33.7 t -57.88 122.6 58.52 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.192 173.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.65 -23.14 70.07 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.419 2.079 . . . . 0.0 112.301 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.734 ' HA ' ' HG3' ' A' ' 106' ' ' LYS . 44.8 t -64.93 -19.74 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 121.239 0.542 . . . . 0.0 110.823 178.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.641 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 1.0 OUTLIER -64.51 -23.98 67.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.065 178.471 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -131.57 35.72 3.81 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.148 0.499 . . . . 0.0 111.107 -172.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.734 ' HG3' ' HA ' ' A' ' 103' ' ' VAL . 9.2 mtpm? . . . . . 0 C--O 1.237 0.445 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.47 174.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.639 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 22.0 t70 . . . . . 0 N--CA 1.462 0.133 0 CA-C-O 121.223 0.535 . . . . 0.0 109.984 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -52.78 -41.32 64.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.475 175.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 1.1 pp0? -70.36 -29.46 66.14 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -178.297 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.639 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 46.9 mtpt -64.9 -39.8 94.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.943 177.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 23.7 mtp180 -66.17 -48.02 72.09 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 174.023 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.435 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 32.2 tp -54.32 -50.17 67.99 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.138 -1.392 . . . . 0.0 112.488 -177.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -71.98 -28.86 63.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.84 0.353 . . . . 0.0 110.873 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -70.66 -50.3 38.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.878 0.37 . . . . 0.0 110.082 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.499 ' O ' HG23 ' A' ' 28' ' ' VAL . 23.1 ptm -67.23 -36.59 81.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.713 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -54.17 -50.57 66.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.115 176.047 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -68.45 -46.35 70.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.131 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mmmt -53.16 -44.77 68.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 24' ' ' MET . 93.4 t -63.62 -42.47 96.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.011 0.434 . . . . 0.0 110.076 177.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 64.5 mtt -81.81 17.7 1.45 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.138 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -118.39 -11.71 9.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.066 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.608 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 13.7 t70 -85.44 145.77 27.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.86 0.362 . . . . 0.0 110.449 -177.293 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 -75.46 -35.47 60.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.668 -173.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -68.97 -40.41 78.89 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.82 -43.93 85.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.834 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.608 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 75.4 mm-40 -56.25 -49.88 72.92 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.242 0.544 . . . . 0.0 110.346 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.45 -49.34 78.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.243 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -63.91 -41.95 97.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.222 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.443 HD11 HD11 ' A' ' 50' ' ' ILE . 1.1 mm? -55.52 -51.42 67.07 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.105 -178.21 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.456 ' HB3' ' HE2' ' A' ' 39' ' ' LYS . 15.5 ptpt -74.67 -24.39 58.79 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.901 0.381 . . . . 0.0 110.99 -177.494 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -63.79 -46.2 86.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.307 0.575 . . . . 0.0 110.378 177.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -114.88 26.45 10.15 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.665 -176.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.412 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 10.8 pt-20 -67.89 -18.19 64.72 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.835 0.35 . . . . 0.0 111.501 -176.232 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -73.45 -26.46 60.95 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.287 0.565 . . . . 0.0 109.794 175.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.7 t -99.2 -42.58 10.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.056 -176.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.4 mt -80.15 144.2 11.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.378 -175.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -114.31 163.31 15.46 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.936 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -55.22 -43.15 74.24 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.309 0.576 . . . . 0.0 111.265 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -69.55 -36.31 76.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.287 -178.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 57.8 ttm -56.13 -38.59 71.03 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.529 174.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.443 HD11 HD11 ' A' ' 38' ' ' LEU . 42.6 mm -61.77 -47.25 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.988 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 46.3 mt-10 -70.91 -30.62 67.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.499 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -70.68 -43.59 68.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.671 0.272 . . . . 0.0 110.752 176.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.0 m -92.92 19.61 7.54 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.41 -179.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -51.74 -51.72 54.02 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.13 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -52.94 -45.08 67.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.579 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.487 ' O ' HD11 ' A' ' 96' ' ' ILE . 38.3 mmtm -63.68 -53.69 47.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.211 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.36 -33.58 75.84 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.695 -177.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.401 ' O ' ' HB3' ' A' ' 62' ' ' GLU . 42.9 t80 -73.65 -41.0 63.3 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.871 0.367 . . . . 0.0 110.477 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.449 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 42.1 tt0 -65.88 -33.04 74.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.495 0.664 . . . . 0.0 109.882 177.099 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -58.71 -51.61 69.24 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.6 177.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.0 pt -75.17 -28.25 20.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.876 -176.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.401 ' HB3' ' O ' ' A' ' 58' ' ' TYR . 0.0 OUTLIER -73.83 -33.06 64.0 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.031 -175.327 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 55.3 mt-30 -81.02 179.48 7.84 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.875 0.369 . . . . 0.0 111.145 -178.123 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.1 t -66.65 117.06 8.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.692 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -75.23 -27.0 59.35 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.394 0.616 . . . . 0.0 110.175 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -102.55 -160.89 0.81 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.41 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -154.46 157.84 39.03 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 177.196 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.6 t -79.21 -9.83 59.67 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.194 0.521 . . . . 0.0 110.703 -172.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -69.69 -11.56 60.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.211 0.529 . . . . 0.0 110.604 173.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 17.8 p -126.49 -40.33 1.95 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.255 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.2 m -99.0 153.44 18.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.1 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.44 16.12 6.92 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.229 0.538 . . . . 0.0 110.691 178.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -68.16 86.21 0.26 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.833 176.059 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -80.41 -11.27 59.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.055 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -81.1 -13.42 58.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.615 -175.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 66.9 m -87.96 115.53 25.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.516 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -78.06 108.11 11.1 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.245 177.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -120.12 135.63 54.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.817 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.668 ' HG ' HD22 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -104.29 -35.93 7.8 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.166 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.668 HD22 ' HG ' ' A' ' 79' ' ' LEU . 3.2 mm? -87.12 49.19 1.77 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.976 170.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -67.41 147.5 52.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.33 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 94.0 -9.03 73.14 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.467 -173.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.42 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 56.2 m-85 -125.0 171.81 9.93 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.452 ' HB2' ' CZ ' ' A' ' 99' ' ' TYR . 0.6 OUTLIER -130.5 147.48 66.11 Favored Pre-proline 0 C--N 1.329 -0.291 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 171.823 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.96 135.49 15.64 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.363 2.042 . . . . 0.0 112.472 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -136.95 146.33 45.27 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 172.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.6 mt -80.72 142.95 33.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.802 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 23.2 m -139.94 141.36 34.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.938 175.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.1 p -93.37 114.68 30.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.498 0.666 . . . . 0.0 110.454 179.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -116.0 96.68 5.69 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.676 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.95 -112.98 4.71 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.665 -177.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.494 ' N ' ' HD2' ' A' ' 92' ' ' ARG . 8.0 mpt_? -106.85 0.9 24.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.909 0.385 . . . . 0.0 110.965 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 12.2 p -121.5 147.58 45.59 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.006 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 55.9 mt -103.66 124.57 58.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.956 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -109.77 177.62 4.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.245 0.545 . . . . 0.0 110.839 -175.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.487 HD11 ' O ' ' A' ' 56' ' ' LYS . 47.4 mt -126.53 105.88 14.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.283 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -105.46 150.75 25.02 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.237 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.42 ' CD2' ' HB2' ' A' ' 83' ' ' TYR . 17.2 m-85 -100.17 126.87 46.49 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.056 179.267 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.452 ' CZ ' ' HB2' ' A' ' 84' ' ' HIS . 54.3 p90 -105.49 144.34 32.39 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 173.045 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -63.2 138.71 58.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.111 0.481 . . . . 0.0 111.069 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 40.6 t -56.63 123.37 57.0 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.456 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.07 -17.15 58.78 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.815 2.343 . . . . 0.0 112.213 -178.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.9 t -69.63 -15.76 19.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.827 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt . . . . . 0 C--O 1.234 0.264 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.27 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.473 ' HA ' ' HG3' ' A' ' 19' ' ' LYS . 2.9 m-20 . . . . . 0 CA--C 1.52 -0.183 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -65.16 -54.89 22.82 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.483 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 27.8 pt20 -66.88 -30.23 70.34 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.41 178.145 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.473 ' HG3' ' HA ' ' A' ' 16' ' ' ASP . 5.9 mmmm -57.98 -48.41 80.06 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 174.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.422 ' O ' ' HG2' ' A' ' 24' ' ' MET . 2.6 tpp180 -66.57 -45.2 80.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.385 177.032 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.483 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 26.8 tp -53.94 -49.42 68.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.319 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -67.02 -40.36 87.24 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.922 177.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 27.3 tt0 -59.29 -51.33 70.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.827 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.426 ' O ' HG23 ' A' ' 28' ' ' VAL . 18.1 ptm -73.55 -37.37 65.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.078 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.496 ' HE2' ' HG2' ' A' ' 51' ' ' GLU . 4.5 tppp? -59.76 -40.51 88.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 110.143 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.68 -50.53 70.78 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.323 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -58.14 -47.0 84.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.524 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.529 ' HA ' HD13 ' A' ' 61' ' ' ILE . 74.8 t -62.66 -42.23 95.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.063 -177.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 24.3 mmt -82.98 15.52 2.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.751 0.31 . . . . 0.0 111.279 -178.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -107.27 -20.38 13.3 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.083 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.689 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 35.1 t70 -77.37 131.36 38.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.937 0.399 . . . . 0.0 111.237 -175.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -59.45 -45.61 91.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.808 -177.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -67.56 -39.43 84.93 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.423 -177.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.8 t -54.83 -49.61 68.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.661 174.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.689 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 36.0 mt-30 -64.38 -40.41 95.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.232 0.539 . . . . 0.0 110.607 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.429 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -59.77 -38.85 82.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.33 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.505 ' CZ ' HG23 ' A' ' 89' ' ' VAL . 59.3 t80 -69.82 -44.26 70.33 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.735 177.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.553 HD11 HD11 ' A' ' 50' ' ' ILE . 1.2 mm? -54.41 -47.91 72.23 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.355 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.6 pttt -76.11 -27.06 56.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.028 0.442 . . . . 0.0 111.114 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 5.3 tp10 -65.57 -42.45 91.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.134 0.492 . . . . 0.0 110.124 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -116.01 27.67 9.11 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.161 -176.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -66.94 -16.1 64.11 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.971 0.415 . . . . 0.0 111.734 -175.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -77.85 -19.41 54.91 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.109 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 40.4 t -113.68 -40.74 3.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.992 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.537 ' CG1' HG21 ' A' ' 89' ' ' VAL . 62.4 mt -72.09 141.92 15.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.499 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -115.48 164.1 14.78 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.461 -0.79 . . . . 0.0 108.87 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -59.92 -40.19 88.01 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -64.88 -38.17 90.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.648 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.6 tpp -58.73 -41.75 87.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.325 177.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.553 HD11 HD11 ' A' ' 38' ' ' LEU . 44.6 mm -61.95 -45.81 97.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.856 178.357 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.761 ' HA ' HD23 ' A' ' 54' ' ' LEU . 34.2 mt-10 -70.35 -33.85 71.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.126 -178.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -64.07 -41.52 97.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.125 0.488 . . . . 0.0 110.123 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.4 m -107.18 27.46 9.02 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.087 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.761 HD23 ' HA ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -55.29 -46.21 76.21 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 121.151 0.501 . . . . 0.0 110.024 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -63.72 -29.64 70.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.017 -176.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.471 ' O ' HD11 ' A' ' 96' ' ' ILE . 65.0 mmtt -68.19 -53.98 21.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.092 0.473 . . . . 0.0 110.103 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.2 mp -65.63 -36.74 84.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.724 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -65.83 -42.16 90.87 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.18 -0.463 . . . . 0.0 109.898 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -58.07 -48.21 80.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.619 175.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.404 ' HD1' ' HB2' ' A' ' 85' ' ' PRO . 51.5 t80 -56.13 -49.26 74.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.47 -177.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.529 HD13 ' HA ' ' A' ' 28' ' ' VAL . 29.7 pt -75.13 -29.55 21.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -174.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -80.39 -30.69 37.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.661 0.267 . . . . 0.0 111.3 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -77.91 -171.78 2.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.159 0.504 . . . . 0.0 110.926 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 31.6 p -74.38 94.03 2.49 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.463 177.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -64.45 -32.93 74.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.614 0.721 . . . . 0.0 109.399 173.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.477 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.0 t-20 -92.22 -159.93 0.7 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.128 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.486 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -153.95 149.57 27.41 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.447 175.604 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.49 ' HA ' ' O ' ' A' ' 71' ' ' SER . 13.7 t -75.21 0.65 15.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.82 -173.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.446 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 5.3 t80 -82.41 -12.68 57.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.199 176.035 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.477 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 25.6 p -127.53 -40.81 1.75 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.57 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.49 ' O ' ' HA ' ' A' ' 68' ' ' SER . 50.2 p -98.34 149.29 22.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 174.461 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 14.9 tt0 -102.35 -2.93 27.93 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.782 -176.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -58.33 133.25 55.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.469 0.652 . . . . 0.0 110.557 -176.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -94.76 5.44 51.86 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.334 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -68.55 -39.74 80.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.889 -177.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 21.8 p -110.44 114.56 28.09 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.965 0.412 . . . . 0.0 110.181 176.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -74.86 107.47 6.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.676 0.751 . . . . 0.0 109.908 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.707 ' OD1' ' HA ' ' A' ' 81' ' ' GLU . 2.9 t-20 -87.98 103.75 15.98 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.772 -176.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 mp -65.53 -65.53 0.66 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.251 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.2 mp -80.4 77.14 7.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.348 174.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.707 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 29.8 tt0 -73.95 132.54 42.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.598 -175.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.14 -7.53 48.13 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.357 -176.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -122.29 162.91 20.61 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -126.04 147.22 58.49 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 169.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.404 ' HB2' ' HD1' ' A' ' 60' ' ' TYR . 46.2 Cg_endo -71.78 136.79 28.52 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.315 2.01 . . . . 0.0 112.358 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.476 ' HB3' ' CD1' ' A' ' 99' ' ' TYR . 20.6 ptmt -128.11 131.72 49.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.416 179.127 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 76.2 mt -78.92 134.66 36.86 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.177 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.2 m -132.18 139.68 49.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.121 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.537 HG21 ' CG1' ' A' ' 45' ' ' ILE . 78.8 t -88.98 114.67 27.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.405 0.621 . . . . 0.0 109.673 175.265 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -117.05 95.32 4.94 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.133 -172.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.17 -113.94 6.29 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.062 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.526 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 0.2 OUTLIER -105.7 18.34 22.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.752 0.31 . . . . 0.0 111.386 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.3 m -138.98 167.62 21.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.09 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 76.2 mt -114.68 131.71 66.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -115.62 177.57 4.62 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 -176.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.471 HD11 ' O ' ' A' ' 56' ' ' LYS . 51.0 mt -132.98 108.88 13.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.285 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -99.55 -174.93 2.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.809 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -133.37 124.26 26.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.927 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.476 ' CD1' ' HB3' ' A' ' 86' ' ' LYS . 55.2 p90 -107.22 152.12 24.52 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 100' ' ' GLU . 0.6 OUTLIER -74.14 130.29 39.49 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.417 0.627 . . . . 0.0 110.616 -175.876 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.41 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 48.9 t -46.31 122.88 6.75 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.587 174.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 14.7 Cg_endo -60.51 -9.58 11.45 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.132 2.555 . . . . 0.0 113.099 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 91.8 t -78.44 -25.23 13.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 177.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.9 tttp . . . . . 0 C--N 1.332 -0.175 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.605 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.469 0.493 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -52.46 -46.97 66.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.2 177.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.423 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -71.43 -30.06 65.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.243 0.544 . . . . 0.0 110.04 -177.909 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -71.13 -42.54 69.08 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.382 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -72.52 -32.26 65.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.751 0.31 . . . . 0.0 110.577 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 tp -65.22 -49.48 69.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.388 177.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.582 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 7.0 mm-40 -73.18 -25.0 60.62 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.923 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -61.96 -56.91 14.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.759 0.314 . . . . 0.0 111.398 174.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.533 ' O ' HG23 ' A' ' 28' ' ' VAL . 23.7 ptm -61.14 -35.56 77.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.956 0.407 . . . . 0.0 109.995 176.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.582 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 4.1 tptm -57.78 -46.18 84.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.923 173.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -53.11 -49.25 66.87 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 123.665 0.786 . . . . 0.0 111.103 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mmmm -59.02 -49.42 77.97 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.783 177.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 24' ' ' MET . 57.6 t -64.18 -41.24 91.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.723 -175.189 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 14.8 ptp -73.73 -4.72 36.23 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -171.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -127.62 -4.08 5.95 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.484 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 0.3 OUTLIER -77.38 126.74 31.39 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.179 0.514 . . . . 0.0 110.239 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -66.68 -33.01 74.7 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.972 -168.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -66.46 -41.23 89.37 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.789 0.328 . . . . 0.0 110.236 177.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 91.3 t -58.28 -44.82 88.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.289 172.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 84.4 mm-40 -55.38 -50.47 69.64 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.922 178.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -54.67 -42.62 71.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.26 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -68.85 -43.44 75.45 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.692 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.712 HD11 HD11 ' A' ' 50' ' ' ILE . 2.4 mm? -61.03 -44.7 97.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.445 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.419 ' HE2' ' HB2' ' A' ' 39' ' ' LYS . 4.1 ptmm? -70.83 -26.05 63.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.045 0.45 . . . . 0.0 110.508 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -73.85 -44.23 56.16 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.974 0.416 . . . . 0.0 110.588 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -112.74 29.02 8.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.505 -176.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -64.22 -22.54 66.98 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.031 0.444 . . . . 0.0 111.354 -176.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -75.11 -25.99 58.91 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.534 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.5 t -101.07 -42.37 9.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.99 -174.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.531 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 65.3 mt -77.87 142.63 13.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.794 -175.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -118.24 165.7 13.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.707 176.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -55.68 -44.33 77.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.901 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.406 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 51.6 mtpt -66.14 -36.89 84.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.086 0.469 . . . . 0.0 110.706 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.531 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 23.0 ttt -60.13 -35.83 76.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.201 177.308 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.712 HD11 HD11 ' A' ' 38' ' ' LEU . 37.0 mm -64.57 -54.45 30.24 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.839 176.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.516 ' HA ' HD23 ' A' ' 54' ' ' LEU . 7.7 mm-40 -57.53 -42.18 82.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.024 0.44 . . . . 0.0 111.014 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -65.36 -29.73 70.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.082 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.447 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 7.3 m -114.26 20.5 15.49 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.38 -178.136 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.516 HD23 ' HA ' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -58.88 -44.7 91.19 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.922 -177.633 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -60.6 -33.67 73.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.782 178.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.574 ' O ' HD11 ' A' ' 96' ' ' ILE . 32.1 mmmt -73.22 -42.76 62.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 110.91 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.446 HD21 HG21 ' A' ' 94' ' ' ILE . 76.2 mt -65.51 -38.79 90.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.143 0.497 . . . . 0.0 110.132 177.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -70.3 -39.26 74.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.115 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.523 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 38.0 tt0 -57.21 -39.72 76.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.012 175.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -59.51 -52.21 66.55 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.525 177.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.7 pt -74.34 -29.0 23.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -174.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.523 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 7.6 pt-20 -75.63 -20.73 58.31 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.811 178.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 46.3 mt-30 -74.36 -167.15 0.49 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.925 0.393 . . . . 0.0 110.322 174.459 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.561 ' HB2' ' C ' ' A' ' 77' ' ' ASN . 20.0 t -83.74 130.16 34.95 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.881 0.372 . . . . 0.0 111.212 -177.197 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -73.05 -26.6 61.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.533 0.682 . . . . 0.0 109.574 173.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -122.78 -160.09 0.87 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.608 -177.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.435 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 6.8 p -152.63 161.11 43.01 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 176.266 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.606 ' HB3' ' HG3' ' A' ' 81' ' ' GLU . 48.1 t -60.24 -29.22 68.63 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 123.49 0.494 . . . . 0.0 111.285 -174.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -72.37 -1.92 17.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.032 0.444 . . . . 0.0 111.617 -178.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.9 p -136.31 6.94 3.08 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.591 175.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 38.5 t -145.35 118.65 8.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.865 0.364 . . . . 0.0 110.302 -176.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -81.81 -6.69 59.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.03 177.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -79.73 134.13 36.37 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.019 -174.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -64.28 -26.4 68.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.079 -0.51 . . . . 0.0 112.328 -176.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -81.49 67.45 7.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.824 0.821 . . . . 0.0 110.238 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.451 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 15.7 p -115.51 116.92 29.0 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.454 172.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.561 ' C ' ' HB2' ' A' ' 64' ' ' SER . 56.4 m-20 -79.08 21.81 0.43 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.653 -173.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.454 ' N ' ' HB2' ' A' ' 64' ' ' SER . 3.0 p-10 -103.66 128.06 51.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.153 0.501 . . . . 0.0 111.272 -177.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.868 ' HG ' HD12 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -90.73 -26.89 19.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 168.869 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.868 HD12 ' HG ' ' A' ' 79' ' ' LEU . 5.5 mp -85.51 110.3 19.1 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.258 173.18 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.606 ' HG3' ' HB3' ' A' ' 68' ' ' SER . 33.5 tt0 -88.48 142.05 28.03 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.091 0.472 . . . . 0.0 110.541 -179.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.2 -8.78 77.44 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.887 176.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -126.43 160.3 30.89 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.919 0.359 . . . . 0.0 110.989 -177.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.7 m80 -128.07 149.32 70.67 Favored Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.005 177.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.98 153.54 25.33 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.548 2.166 . . . . 0.0 112.166 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -152.6 151.96 31.25 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -82.57 142.65 31.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.964 0.411 . . . . 0.0 110.346 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.493 ' CG2' ' HB3' ' A' ' 95' ' ' ASP . 33.1 m -132.49 155.42 41.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.622 176.008 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.42 HG23 ' CE ' ' A' ' 49' ' ' MET . 4.3 p -99.92 115.15 40.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-O 121.168 0.508 . . . . 0.0 110.08 175.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -120.17 95.82 4.9 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.866 177.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.64 -124.11 28.41 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.088 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -96.59 13.9 26.61 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.83 0.348 . . . . 0.0 111.0 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.5 m -125.24 144.42 50.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.663 -178.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.447 ' HB ' ' CB ' ' A' ' 53' ' ' SER . 60.8 mt -97.56 131.78 43.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 174.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.493 ' HB3' ' CG2' ' A' ' 88' ' ' VAL . 41.3 t0 -126.46 178.08 6.08 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.745 0.307 . . . . 0.0 110.254 -170.229 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.574 HD11 ' O ' ' A' ' 56' ' ' LYS . 77.0 mt -124.39 129.94 73.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-O 121.249 0.547 . . . . 0.0 110.273 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -122.49 172.33 8.44 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.283 177.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -124.42 134.99 52.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.008 0.432 . . . . 0.0 111.268 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -118.21 151.2 38.08 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.588 ' HG2' ' HD3' ' A' ' 104' ' ' LYS . 24.4 tt0 -71.84 137.19 47.36 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.979 0.419 . . . . 0.0 110.582 -175.477 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.443 ' SG ' HG12 ' A' ' 103' ' ' VAL . 19.8 t -47.58 124.8 9.8 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.505 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.37 -10.91 25.74 Favored 'Trans proline' 0 N--CA 1.474 0.337 0 C-N-CA 123.198 2.599 . . . . 0.0 113.493 -176.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.443 HG12 ' SG ' ' A' ' 101' ' ' CYS . 9.8 p -66.61 -19.39 25.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.282 0.563 . . . . 0.0 110.306 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.588 ' HD3' ' HG2' ' A' ' 100' ' ' GLU . 8.3 mtpm? . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.219 -178.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 . . . . . 0 C--O 1.234 0.261 0 CA-C-O 120.935 0.398 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -52.17 -47.64 65.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.537 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.409 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 17.4 pt20 -68.88 -30.75 69.32 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.208 -175.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 30.3 mmtm -72.13 -38.16 69.32 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -175.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.405 ' HD2' HH11 ' A' ' 20' ' ' ARG . 19.1 ptt85 -75.52 -23.78 56.73 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.444 176.039 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.4 tp -70.48 -48.57 55.12 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.12 174.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 18' ' ' GLN . 37.0 mt-10 -58.92 -43.2 91.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.884 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -58.29 -53.71 55.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.999 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.629 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.3 ptm -68.68 -42.3 78.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.287 -177.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -61.25 -43.06 99.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.719 0.295 . . . . 0.0 110.777 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -64.88 -46.4 81.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.059 0.457 . . . . 0.0 110.173 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -55.75 -45.39 78.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.949 178.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 24' ' ' MET . 74.3 t -62.08 -37.54 78.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.939 0.4 . . . . 0.0 110.79 -179.216 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.8 mtp -82.3 -2.97 54.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.59 -178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -103.8 -6.57 21.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.305 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.413 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 26.1 t70 -77.93 137.61 38.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.824 0.345 . . . . 0.0 110.489 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -67.57 -43.47 80.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.483 -175.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -70.42 -43.67 69.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.53 -177.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.9 t -54.99 -55.18 17.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.855 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 11.0 pt20 -65.61 -34.21 77.7 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -176.61 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.91 -41.61 86.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.265 0.555 . . . . 0.0 110.192 175.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.507 ' HZ ' HG23 ' A' ' 89' ' ' VAL . 88.4 t80 -61.8 -38.94 89.99 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.812 176.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.82 HD11 HD11 ' A' ' 50' ' ' ILE . 1.6 mm? -61.25 -50.47 72.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.794 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -70.0 -23.1 63.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.025 0.44 . . . . 0.0 111.054 -177.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -76.15 -37.52 57.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.958 176.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -110.71 25.18 12.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.701 -174.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -63.67 -20.78 65.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.076 0.465 . . . . 0.0 111.311 -176.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -75.5 -20.44 58.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.574 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.4 t -108.06 -46.98 7.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.802 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 89' ' ' VAL . 54.6 mt -81.33 144.16 10.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.979 -173.04 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.494 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -130.83 -178.65 4.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.442 176.454 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -64.36 -42.25 96.31 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -60.03 -44.79 94.39 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.589 0.233 . . . . 0.0 110.609 177.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.421 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 38.5 ttm -56.25 -38.95 71.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.537 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.82 HD11 HD11 ' A' ' 38' ' ' LEU . 46.1 mm -60.52 -54.12 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.945 177.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -62.09 -38.11 87.63 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.129 0.49 . . . . 0.0 111.068 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -69.68 -26.46 64.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.608 -178.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 77.3 p -114.37 16.48 17.82 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.265 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.94 -42.68 69.09 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.456 0.646 . . . . 0.0 110.508 178.296 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.519 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 24.4 p-10 -59.67 -44.46 93.59 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.738 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.589 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.1 mmmt -67.48 -49.94 61.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.557 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.6 -41.07 76.39 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.531 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -67.39 -42.77 82.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.072 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 15.9 mm-40 -58.87 -39.36 81.12 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-O 120.9 0.381 . . . . 0.0 110.763 177.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -58.88 -51.33 70.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.531 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.6 pt -71.64 -29.69 35.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.702 -174.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.75 -23.25 55.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.014 0.435 . . . . 0.0 111.093 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 46.9 mt-30 -80.26 167.75 19.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.048 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.2 m -66.9 113.4 4.92 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.52 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -64.83 -26.19 68.23 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.781 172.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -102.19 -163.18 0.98 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.664 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.7 p -159.6 158.04 30.9 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.0 m -67.32 -25.4 66.0 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.067 0.461 . . . . 0.0 110.775 -172.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 104' ' ' LYS . 1.3 t80 -67.76 -5.89 18.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.57 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 28.7 p -135.92 2.63 2.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.749 0.309 . . . . 0.0 111.1 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.8 m -124.33 145.27 49.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.898 0.38 . . . . 0.0 110.16 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -77.26 -13.55 59.92 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.271 0.557 . . . . 0.0 110.844 -175.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.552 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 0.3 OUTLIER -80.13 87.06 5.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.435 179.561 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -68.37 -11.13 59.11 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.583 0.706 . . . . 0.0 110.151 175.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -73.71 -17.58 61.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.218 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.552 ' SG ' ' HB3' ' A' ' 73' ' ' ASP . 59.8 m -71.27 117.4 12.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.892 0.377 . . . . 0.0 111.023 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -87.31 99.83 12.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.996 0.427 . . . . 0.0 110.007 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -102.05 129.75 48.44 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.499 -177.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.596 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.5 pt? -66.9 -24.35 66.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.415 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.485 HD12 ' HG ' ' A' ' 79' ' ' LEU . 5.3 mp -141.96 103.84 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 174.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -94.69 150.49 20.17 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 -176.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.52 -9.41 77.18 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.389 -174.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -124.18 166.99 14.88 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 99' ' ' TYR . 0.5 OUTLIER -127.62 146.84 60.12 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 169.989 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.3 145.77 39.13 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.063 1.842 . . . . 0.0 111.513 175.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -142.03 149.63 40.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.096 177.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.7 mt -83.59 135.59 34.56 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.058 177.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.478 HG11 ' HG3' ' A' ' 97' ' ' GLU . 29.7 m -133.81 150.63 31.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.616 HG22 HG12 ' A' ' 94' ' ' ILE . 48.4 t -109.84 112.67 41.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.341 0.591 . . . . 0.0 109.499 172.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -108.87 104.07 13.25 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.798 -177.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.74 -105.03 1.42 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.833 -0.699 . . . . 0.0 111.525 -177.063 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -117.21 5.06 12.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.737 0.303 . . . . 0.0 110.575 178.065 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.6 p -122.29 138.02 54.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.789 0.328 . . . . 0.0 111.392 -176.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.616 HG12 HG22 ' A' ' 89' ' ' VAL . 66.1 mt -90.53 137.52 21.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.848 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -134.38 178.86 6.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.808 0.337 . . . . 0.0 110.774 -176.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.589 HD11 ' O ' ' A' ' 56' ' ' LYS . 51.8 mt -123.49 110.61 26.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.354 -177.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.478 ' HG3' HG11 ' A' ' 88' ' ' VAL . 7.0 mm-40 -102.83 179.45 4.28 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.24 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -128.25 133.56 48.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.586 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.416 ' CZ ' ' HB2' ' A' ' 84' ' ' HIS . 52.1 p90 -115.91 140.59 49.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.007 174.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -56.82 127.11 30.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.906 178.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.2 t -52.71 122.31 26.4 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.792 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -63.02 -1.12 2.56 Favored 'Trans proline' 0 N--CA 1.476 0.494 0 C-N-CA 123.37 2.713 . . . . 0.0 113.432 -176.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.8 t -79.83 -44.3 23.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.412 175.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.513 ' HB3' ' CE2' ' A' ' 69' ' ' TYR . 14.7 ptmm? . . . . . 0 C--N 1.333 -0.139 0 CA-C-O 120.853 0.359 . . . . 0.0 110.874 -178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.423 ' OD2' ' HD2' ' A' ' 20' ' ' ARG . 16.2 t70 . . . . . 0 N--CA 1.466 0.338 0 CA-C-O 120.533 0.206 . . . . 0.0 111.278 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -53.74 -56.12 20.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.17 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -72.11 -30.64 65.28 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.208 -176.818 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 25.8 mmmt -67.56 -46.5 72.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.475 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.495 ' O ' ' HG2' ' A' ' 24' ' ' MET . 11.4 ptm180 -71.15 -26.59 63.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.0 tp -68.69 -48.82 62.93 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.973 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 11.6 pt-20 -70.77 -30.58 67.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.75 0.309 . . . . 0.0 110.59 175.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 38.6 tt0 -64.73 -53.89 40.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.697 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.495 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 12.0 ptp -61.79 -38.65 88.89 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.464 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 29' ' ' MET . 4.3 tppp? -56.15 -50.26 71.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.323 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.24 -49.93 75.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.635 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -52.01 -51.84 54.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.773 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.456 ' CG1' HG11 ' A' ' 34' ' ' VAL . 84.7 t -62.8 -34.42 65.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.326 -177.221 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.7 mmt -73.74 -8.93 57.92 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.452 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -102.94 -8.64 20.51 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -176.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -85.28 131.15 34.46 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.391 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.36 -42.06 98.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.152 -178.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -68.99 -45.4 70.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.018 0.437 . . . . 0.0 110.438 -175.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.456 HG11 ' CG1' ' A' ' 28' ' ' VAL . 44.7 t -56.85 -55.41 20.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.534 178.348 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -65.3 -31.64 72.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.799 0.333 . . . . 0.0 111.447 -176.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.2 -42.34 88.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.977 0.418 . . . . 0.0 110.526 174.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -65.75 -37.57 86.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.734 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.3 mm? -57.85 -44.89 86.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.242 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -24.21 40.89 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.77 0.319 . . . . 0.0 110.681 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.88 -49.89 73.07 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.313 0.578 . . . . 0.0 110.343 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -115.62 31.42 6.72 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.273 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.88 -23.41 65.16 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -175.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -85.13 -25.45 27.47 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.222 0.535 . . . . 0.0 110.661 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.4 t -96.12 -40.83 11.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.117 -174.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.7 mt -70.53 140.54 18.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.836 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.425 ' HB2' ' H ' ' A' ' 49' ' ' MET . 16.5 m-20 -91.92 151.02 20.72 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.53 176.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -61.4 -36.28 79.86 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -63.61 -43.06 98.0 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.321 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.425 ' H ' ' HB2' ' A' ' 46' ' ' ASP . 45.2 ttm -55.63 -37.87 68.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.9 178.335 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.6 mm -63.24 -49.11 84.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.866 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -58.47 -38.04 76.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.264 0.554 . . . . 0.0 110.777 178.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -77.68 -29.96 51.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.476 -176.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 m -106.06 11.68 31.21 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -174.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.8 tp -57.33 -38.1 73.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.867 0.365 . . . . 0.0 110.656 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -60.21 -39.43 86.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.089 177.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -69.9 -43.02 72.59 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.966 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.429 ' O ' HG23 ' A' ' 61' ' ' ILE . 10.8 mp -61.89 -40.63 96.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.351 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.48 ' O ' HG12 ' A' ' 61' ' ' ILE . 13.3 t80 -66.88 -44.17 81.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.993 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.11 -45.33 91.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.383 0.611 . . . . 0.0 110.064 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -58.79 -40.26 83.52 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.595 -178.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.52 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 23.4 pt -75.55 -30.11 21.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.551 -176.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -83.79 -22.76 31.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.785 0.326 . . . . 0.0 111.081 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -105.21 145.01 31.2 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -172.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.593 ' HB3' ' HG3' ' A' ' 85' ' ' PRO . 25.6 t 53.33 34.72 18.53 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 160.531 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.52 ' HE2' ' HA ' ' A' ' 61' ' ' ILE . 52.8 mmtt -63.02 -26.07 68.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.918 -0.489 . . . . 0.0 111.347 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -131.59 -166.95 1.79 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.042 0.448 . . . . 0.0 110.328 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.8 p -158.13 161.42 37.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.9 p -62.81 -26.68 68.86 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.221 0.534 . . . . 0.0 112.398 -171.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CE2' ' HA ' ' A' ' 104' ' ' LYS . 1.2 t80 -69.0 -16.66 63.78 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.753 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.467 ' HB3' HG21 ' A' ' 103' ' ' VAL . 25.8 p -124.8 5.71 8.1 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.81 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 m -137.16 152.72 50.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 179.049 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -82.03 -20.03 39.19 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.49 105.39 0.52 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.016 173.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -80.09 -13.39 59.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.223 0.535 . . . . 0.0 110.776 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -87.1 74.61 9.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.471 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 36.2 m -86.47 139.29 31.03 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.672 -176.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -92.26 37.7 0.99 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 171.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -115.26 138.2 51.2 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.176 -172.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.4 mp -80.14 -68.57 0.66 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.423 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.424 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 7.4 mp -85.49 100.83 12.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.876 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -63.68 139.5 58.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.125 0.488 . . . . 0.0 110.698 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.87 -8.69 79.0 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.454 -176.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.409 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 16.3 m-85 -121.96 168.87 11.4 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 122.248 0.219 . . . . 0.0 110.516 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -131.97 153.72 81.48 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.593 ' HG3' ' HB3' ' A' ' 64' ' ' SER . 93.9 Cg_endo -79.0 151.15 23.8 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.638 2.226 . . . . 0.0 112.085 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.408 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 61.9 tttp -147.85 137.36 22.44 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.645 176.35 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.402 HD23 HG12 ' A' ' 96' ' ' ILE . 90.9 mt -68.4 131.76 45.87 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.326 178.471 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 18.7 m -135.8 149.92 28.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.798 178.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.9 p -104.33 116.75 48.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.386 0.612 . . . . 0.0 110.765 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -112.91 99.0 7.54 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.445 176.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.75 -118.36 6.07 Favored Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.432 -175.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 34.8 mmt180 -111.12 14.17 21.85 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.922 0.392 . . . . 0.0 110.663 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.6 p -122.26 141.9 51.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.677 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 84.1 mt -97.53 130.21 46.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.962 0.411 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -118.12 175.3 5.75 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.427 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.402 HG12 HD23 ' A' ' 87' ' ' LEU . 58.1 mt -128.14 98.06 4.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.787 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -103.91 -175.86 2.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.718 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.424 ' CD2' ' HB2' ' A' ' 80' ' ' LEU . 9.1 m-85 -123.8 138.48 54.5 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -171.328 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.408 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 12.4 p90 -115.06 157.45 23.5 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 170.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -73.69 142.71 46.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.808 0.337 . . . . 0.0 111.613 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.7 t -60.55 122.77 70.27 Favored Pre-proline 0 C--N 1.333 -0.135 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.563 177.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -58.72 -17.03 33.76 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.995 2.463 . . . . 0.0 112.761 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.467 HG21 ' HB3' ' A' ' 70' ' ' CYS . 93.0 t -66.49 -16.85 21.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.953 175.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.462 ' HA ' ' CE2' ' A' ' 69' ' ' TYR . 36.7 ttpt . . . . . 0 C--N 1.33 -0.249 0 CA-C-O 121.313 0.578 . . . . 0.0 109.829 177.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.606 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 1.2 m-20 . . . . . 0 CA--C 1.523 -0.089 0 N-CA-C 111.536 0.198 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -59.83 -52.8 63.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 173.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -71.13 -33.24 69.91 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.606 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 45.1 mtpt -58.71 -44.23 90.31 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.218 176.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.448 ' O ' ' HG2' ' A' ' 24' ' ' MET . 18.0 tpp85 -69.45 -51.36 36.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.704 177.095 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.7 tp -58.07 -49.86 75.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.467 -175.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -76.94 -27.3 54.78 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 52.5 tt0 -63.12 -55.57 24.21 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 120.923 0.392 . . . . 0.0 110.077 175.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.632 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.9 ptm -61.84 -34.02 75.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.158 177.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.427 ' HE3' ' HB2' ' A' ' 25' ' ' LYS . 3.7 tppp? -55.29 -55.62 29.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.101 174.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.564 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 39.4 tt0 -62.68 -40.39 96.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.651 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.459 ' HE2' ' HB3' ' A' ' 27' ' ' LYS . 5.2 mmmm -52.39 -39.82 61.32 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.467 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.724 HG12 HG11 ' A' ' 34' ' ' VAL . 68.0 t -70.27 -39.01 76.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.11 -178.394 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 65.7 mtt -73.9 -4.81 37.32 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.532 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 27.3 mmtp -98.81 -5.82 30.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.738 0.304 . . . . 0.0 111.506 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -84.81 141.34 30.55 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.111 0.481 . . . . 0.0 111.201 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -69.94 -39.93 75.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.899 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -77.49 -42.15 36.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.902 0.382 . . . . 0.0 109.997 -174.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.724 HG11 HG12 ' A' ' 28' ' ' VAL . 40.0 t -54.57 -55.49 14.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.214 177.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -65.44 -32.56 74.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.755 0.312 . . . . 0.0 111.217 -177.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.69 -40.12 92.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.003 174.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -65.77 -40.45 92.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.608 176.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.82 HD11 HD11 ' A' ' 50' ' ' ILE . 2.0 mm? -57.54 -45.61 84.89 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.468 178.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -79.77 -20.46 46.22 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.926 0.394 . . . . 0.0 110.804 -178.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -68.4 -52.33 34.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.551 0.691 . . . . 0.0 109.966 176.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -106.86 29.97 6.55 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.329 -177.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -64.68 -16.08 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.283 0.563 . . . . 0.0 110.676 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.12 -19.89 59.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.579 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 39.8 t -119.37 -37.37 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.542 -173.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.8 mt -73.52 140.14 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.322 0.582 . . . . 0.0 111.919 -174.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.79 165.28 11.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.21 176.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -67.89 -36.99 81.2 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 172.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -57.69 -43.66 85.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.227 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 46.6 ttm -59.78 -37.17 78.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.851 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.82 HD11 HD11 ' A' ' 38' ' ' LEU . 38.6 mm -63.25 -54.89 27.25 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.174 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.8 mm-40 -50.83 -46.93 60.2 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 122.978 0.511 . . . . 0.0 111.459 176.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -68.74 -38.94 80.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.991 -177.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.418 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 5.6 m -101.67 17.38 23.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.342 0.592 . . . . 0.0 110.337 -176.103 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.479 HD23 HG22 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -65.36 -43.81 89.64 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.343 -174.658 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -57.54 -34.48 69.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.715 175.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.425 ' O ' HD11 ' A' ' 96' ' ' ILE . 66.5 mmtt -67.27 -53.65 28.01 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.903 0.382 . . . . 0.0 110.807 178.096 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.424 HD11 HG21 ' A' ' 94' ' ' ILE . 10.9 mp -62.72 -39.68 94.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.465 -177.167 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.429 ' O ' ' HG2' ' A' ' 62' ' ' GLU . 48.2 t80 -67.5 -41.24 84.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.986 0.422 . . . . 0.0 110.383 178.171 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 23.5 tt0 -62.54 -41.18 98.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.978 178.387 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -56.03 -52.81 62.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.832 178.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.6 pt -69.39 -29.86 43.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -174.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 58' ' ' TYR . 60.9 mm-40 -79.17 -17.04 55.69 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.923 0.392 . . . . 0.0 110.927 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 88.5 mt-30 -82.42 -175.3 5.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.423 0.63 . . . . 0.0 111.904 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.1 p -74.42 114.7 13.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.016 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -73.78 -27.53 61.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.912 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.482 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.0 t-20 -115.24 -170.64 1.8 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.03 -170.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.453 ' SG ' ' HB3' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -134.23 143.69 47.97 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.735 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 11.9 t -71.93 -11.5 60.82 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.256 -169.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.453 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 34.4 t80 -63.51 -31.75 73.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.917 175.406 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.482 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 32.1 p -114.64 -20.17 10.8 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.582 -0.447 . . . . 0.0 112.072 -173.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.5 p -113.42 142.85 45.4 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -112.51 24.55 12.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.525 0.678 . . . . 0.0 110.028 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.14 139.81 46.65 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.963 175.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -62.59 -24.03 67.34 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.937 -178.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -102.31 -1.39 31.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.669 -174.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 17.5 p -93.26 19.8 7.74 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.68 -174.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -71.84 96.35 1.64 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.425 0.631 . . . . 0.0 110.189 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -87.14 141.95 28.27 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.335 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.479 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.3 pt? -61.59 -40.56 95.21 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.055 0.455 . . . . 0.0 110.031 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 24.3 mt -86.32 158.36 19.68 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 172.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -140.48 131.16 25.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.483 0.658 . . . . 0.0 110.742 -170.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 80.69 6.08 89.58 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.893 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.436 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 77.2 m-85 -132.51 156.45 46.77 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 122.261 0.224 . . . . 0.0 110.533 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -126.95 150.6 72.29 Favored Pre-proline 0 N--CA 1.466 0.347 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 175.137 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.55 149.89 27.54 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 122.552 2.168 . . . . 0.0 112.408 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.1 pttt -147.34 160.1 42.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.118 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -87.2 138.54 31.4 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.538 HG11 ' OE1' ' A' ' 97' ' ' GLU . 18.1 m -133.5 150.39 32.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.554 178.391 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 p -102.46 120.7 52.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.47 0.652 . . . . 0.0 110.789 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -122.54 99.94 6.67 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.732 176.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.405 ' C ' ' HD2' ' A' ' 92' ' ' ARG . . . 67.66 -111.64 4.21 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.548 -176.174 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.429 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.3 mpt_? -114.4 15.82 17.89 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.187 0.518 . . . . 0.0 109.884 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.1 p -125.89 138.65 53.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.762 -178.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.424 HG21 HD11 ' A' ' 57' ' ' LEU . 67.4 mt -98.3 132.88 42.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 178.554 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -124.89 178.92 5.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -176.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.425 HD11 ' O ' ' A' ' 56' ' ' LYS . 50.2 mt -124.51 108.78 21.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.866 0.365 . . . . 0.0 110.59 -176.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.538 ' OE1' HG11 ' A' ' 88' ' ' VAL . 51.5 mt-10 -106.87 -178.14 3.56 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.134 177.121 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.436 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 4.5 m-85 -123.72 132.84 53.91 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.739 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -110.01 154.5 23.09 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -72.77 136.95 45.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.29 0.566 . . . . 0.0 110.848 -175.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 49.2 t -59.29 126.1 80.92 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.051 178.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 9.4 Cg_endo -55.7 -24.0 43.75 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.795 2.33 . . . . 0.0 111.984 176.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 t -81.44 -14.27 12.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.176 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 28.7 tptp . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.535 -173.346 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.3 t70 . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.91 0.386 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -65.58 -48.42 72.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.693 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.9 pp0? -69.42 -31.67 70.16 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 52.1 mtpt -60.43 -50.11 74.88 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.987 175.027 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -63.95 -45.96 86.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.247 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.7 tp -58.06 -50.14 74.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.664 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 43.5 mm-40 -75.71 -26.97 58.02 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.4 tp-100 -57.98 -57.06 14.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.108 0.48 . . . . 0.0 109.713 174.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.505 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.8 ptm -65.65 -36.08 82.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.522 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 4.9 tppp? -54.01 -52.54 60.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.564 175.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.461 ' HA ' ' HG2' ' A' ' 29' ' ' MET . 38.2 tt0 -66.8 -43.56 83.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.866 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.3 mtpt -56.09 -41.86 75.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.639 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 24' ' ' MET . 73.7 t -64.44 -44.07 97.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.693 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.461 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 23.6 ptp -82.03 2.1 32.6 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.195 0.521 . . . . 0.0 110.765 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 13.9 tptt -94.74 -29.24 14.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.048 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -66.27 143.95 56.9 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.398 0.618 . . . . 0.0 111.538 -174.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -69.11 -47.14 65.93 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.444 -175.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -71.45 -42.8 67.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.798 -177.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.494 HG22 HD11 ' A' ' 87' ' ' LEU . 51.0 t -56.48 -54.6 26.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.758 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -65.92 -30.71 71.33 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.383 -176.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.545 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . . . -62.52 -44.31 96.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.127 174.013 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.443 ' CE2' HD11 ' A' ' 45' ' ' ILE . 60.1 t80 -64.13 -39.62 94.42 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.676 177.045 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.603 HD11 HD11 ' A' ' 50' ' ' ILE . 2.6 mm? -58.37 -51.78 68.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.636 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.545 ' HE3' ' HA ' ' A' ' 36' ' ' ALA . 23.4 pttp -67.42 -28.16 67.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.023 0.439 . . . . 0.0 110.764 -177.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.81 -28.29 62.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.735 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -122.92 26.81 7.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.707 -174.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -66.52 -15.99 63.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.204 0.526 . . . . 0.0 110.968 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -70.9 -34.83 71.94 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.187 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 19.2 t -102.63 -39.56 6.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.366 -172.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.443 HD11 ' CE2' ' A' ' 37' ' ' PHE . 63.9 mt -75.96 138.46 20.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.069 -175.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.466 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -131.44 -177.72 4.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.905 -178.311 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -57.93 -41.47 82.8 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.758 0.313 . . . . 0.0 111.487 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -71.05 -42.04 69.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.58 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 45.9 tpp -56.26 -36.2 68.3 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.778 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.603 HD11 HD11 ' A' ' 38' ' ' LEU . 41.4 mm -63.94 -49.27 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.896 177.399 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -68.65 -37.85 79.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.853 -178.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -58.94 -48.47 81.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.158 0.504 . . . . 0.0 110.863 176.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.644 ' OG ' ' HB ' ' A' ' 94' ' ' ILE . 33.6 t -98.8 17.03 20.41 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.769 -173.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 41.4 tp -60.16 -38.15 82.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.794 0.33 . . . . 0.0 110.457 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -74.17 -35.7 64.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.204 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -66.63 -47.01 73.93 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.856 0.36 . . . . 0.0 110.811 177.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 53' ' ' SER . 95.1 mt -66.2 -39.07 89.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.632 -178.155 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -71.61 -37.89 70.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.241 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.675 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 31.2 tt0 -64.29 -36.81 85.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.186 0.517 . . . . 0.0 109.806 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.524 ' CE1' ' HB2' ' A' ' 85' ' ' PRO . 79.8 t80 -56.46 -51.15 69.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.184 176.305 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -74.9 -29.7 22.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -174.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.675 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 7.5 pt-20 -80.14 -13.07 59.55 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.167 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.532 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 45.6 mt-30 -85.63 -177.58 6.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.022 0.439 . . . . 0.0 110.54 174.318 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.1 t -87.47 105.15 17.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.311 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -69.4 -26.34 64.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.418 . . . . 0.0 109.991 175.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -83.0 -178.27 7.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.881 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 p -147.41 154.7 41.18 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.509 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 3.0 p -55.24 -33.48 63.16 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 124.239 0.962 . . . . 0.0 112.334 -174.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -62.54 -9.89 10.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.722 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.2 p -140.17 -0.79 1.61 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.466 ' OG ' ' HA ' ' A' ' 68' ' ' SER . 27.0 p -105.79 107.23 18.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.385 0.612 . . . . 0.0 111.307 -176.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -86.28 67.87 10.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.745 1.26 . . . . 0.0 109.255 176.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -153.79 156.97 38.69 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 113.006 -1.906 . . . . 0.0 108.435 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.64 -20.36 65.62 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 123.432 0.458 . . . . 0.0 111.563 -178.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -69.65 80.6 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.66 0.743 . . . . 0.0 111.2 177.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.509 ' SG ' ' HB3' ' A' ' 68' ' ' SER . 48.3 t -108.11 23.54 14.34 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.073 176.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -83.44 25.02 0.78 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.982 -174.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -80.14 139.35 36.86 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 174.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.431 ' HB3' HD12 ' A' ' 80' ' ' LEU . 3.0 tt -69.72 -65.19 0.75 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.961 0.41 . . . . 0.0 110.091 -177.138 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 79' ' ' LEU . 6.6 mp -85.64 122.14 29.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.94 0.4 . . . . 0.0 109.96 177.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -94.82 139.66 30.98 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.091 0.472 . . . . 0.0 110.196 178.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.35 -7.71 81.42 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.733 -178.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -121.27 164.2 17.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.456 0.169 . . . . 0.0 110.627 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.455 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 0.9 OUTLIER -128.51 145.12 54.69 Favored Pre-proline 0 CA--C 1.515 -0.4 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.853 173.623 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.524 ' HB2' ' CE1' ' A' ' 60' ' ' TYR . 20.4 Cg_exo -64.0 135.55 48.23 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.516 2.144 . . . . 0.0 111.823 174.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.631 ' HG3' ' HB3' ' A' ' 97' ' ' GLU . 17.3 ptmt -134.21 146.74 50.4 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.175 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.494 HD11 HG22 ' A' ' 34' ' ' VAL . 98.1 mt -86.92 135.4 33.32 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 120.791 0.329 . . . . 0.0 110.705 -179.177 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 15.5 m -134.35 139.77 47.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.409 177.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.5 p -77.95 122.44 32.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 173.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -123.14 95.45 4.61 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.959 -171.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.449 ' C ' ' HD2' ' A' ' 92' ' ' ARG . . . 61.6 -106.97 1.31 Allowed Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.466 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.518 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 2.4 mpt_? -111.86 19.63 17.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.03 0.443 . . . . 0.0 110.958 -178.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 13.3 t -145.41 178.68 7.93 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.644 ' HB ' ' OG ' ' A' ' 53' ' ' SER . 75.5 mt -116.33 137.33 50.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 174.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -130.51 177.07 7.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.156 0.503 . . . . 0.0 110.953 -173.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 61.7 mt -118.8 122.62 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.852 -176.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.631 ' HB3' ' HG3' ' A' ' 86' ' ' LYS . 14.4 tt0 -107.74 -176.76 3.15 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.425 178.54 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.455 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 9.6 m-85 -137.45 134.76 36.19 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 110.529 -0.174 . . . . 0.0 110.529 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.45 ' CD2' ' HB3' ' A' ' 86' ' ' LYS . 53.4 p90 -117.61 160.83 20.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.215 176.488 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -72.55 126.03 28.87 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.379 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.428 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 43.4 t -51.01 123.04 18.36 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.523 174.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 9.2 Cg_endo -56.96 -18.7 29.12 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.306 2.671 . . . . 0.0 113.15 178.735 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.3 t -74.83 -13.01 15.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.148 0.499 . . . . 0.0 110.769 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 53.3 mmtt . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.819 173.97 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.533 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 30.9 t70 . . . . . 0 C--O 1.232 0.182 0 CA-C-O 121.245 0.545 . . . . 0.0 110.051 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.13 -49.83 72.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.909 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -67.92 -30.42 69.74 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 121.166 -0.214 . . . . 0.0 110.587 -178.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.533 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 48.8 mtmt -63.51 -50.11 70.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.96 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 20' ' ' ARG . 11.5 ptm180 -72.54 -28.05 62.6 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.769 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 35.3 tp -67.62 -49.98 60.34 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.858 0.361 . . . . 0.0 110.802 178.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -64.93 -32.66 74.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.419 176.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -62.33 -57.38 11.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.409 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.45 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.7 ptm -63.51 -39.04 93.38 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.792 -179.439 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.58 ' O ' ' HG2' ' A' ' 29' ' ' MET . 19.3 tptp -60.22 -48.85 79.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.457 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.405 ' O ' ' HB3' ' A' ' 30' ' ' LYS . 5.7 tp10 -54.08 -50.35 66.99 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.316 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.62 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 62.8 mtpt -54.86 -48.35 73.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.615 -176.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.563 ' HA ' HD13 ' A' ' 61' ' ' ILE . 91.3 t -64.63 -46.18 93.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.078 0.466 . . . . 0.0 111.112 -176.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.58 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.2 ptt? -88.08 5.99 38.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.442 0.639 . . . . 0.0 110.463 -171.55 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.653 ' HD2' ' N ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -102.81 -34.71 8.9 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.087 -0.961 . . . . 0.0 109.875 175.159 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.653 ' N ' ' HD2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -59.42 132.02 52.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.314 -172.523 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -62.9 -41.93 99.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.939 -172.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -60.1 -39.08 84.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.421 0.629 . . . . 0.0 110.207 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 97.5 t -65.27 -37.93 81.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.663 -179.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 70.9 mm-40 -58.76 -54.09 51.05 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.183 0.516 . . . . 0.0 110.766 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.24 -35.11 76.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.24 -176.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.506 ' CZ ' HG23 ' A' ' 89' ' ' VAL . 82.0 t80 -71.35 -42.4 68.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.714 178.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.757 HD11 HD11 ' A' ' 50' ' ' ILE . 1.1 mm? -59.31 -43.35 92.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.585 -179.053 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -79.14 -25.33 42.9 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.607 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -65.41 -54.75 24.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.304 0.573 . . . . 0.0 110.402 177.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -103.01 30.0 5.1 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.359 -174.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -60.46 -32.47 71.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -175.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -69.88 -28.99 66.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.238 0.542 . . . . 0.0 110.478 -177.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.2 t -97.54 -43.86 12.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.605 -176.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.729 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 66.2 mt -72.36 142.56 15.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.534 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -120.5 164.35 16.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.853 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -54.56 -45.0 73.4 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.305 0.574 . . . . 0.0 110.558 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -66.99 -35.83 80.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.616 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.729 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 23.0 ttt -59.91 -36.59 77.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.402 177.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.757 HD11 HD11 ' A' ' 38' ' ' LEU . 44.0 mm -62.74 -50.94 77.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.537 177.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.84 -39.31 93.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.634 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -60.95 -42.81 98.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.175 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.448 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.7 m -107.62 22.98 15.16 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.976 -175.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 25.6 tp -64.9 -26.33 68.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.01 0.433 . . . . 0.0 109.872 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -67.86 -41.23 83.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.166 176.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -67.71 -50.59 56.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.257 176.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 53' ' ' SER . 83.1 mt -58.19 -40.19 80.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.022 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -71.9 -45.88 59.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.29 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.553 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 40.7 tt0 -62.4 -34.79 77.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.369 0.604 . . . . 0.0 110.163 178.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -56.99 -53.27 59.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.295 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.563 HD13 ' HA ' ' A' ' 28' ' ' VAL . 41.9 pt -73.81 -30.6 28.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -174.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.553 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 8.7 pt-20 -78.74 -19.75 51.58 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 120.939 -0.305 . . . . 0.0 111.53 -177.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -73.2 -177.93 2.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.118 0.485 . . . . 0.0 110.964 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.583 ' HB2' ' HB2' ' A' ' 77' ' ' ASN . 13.7 t -71.42 114.17 9.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.217 -177.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -64.59 -44.66 89.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.004 -179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -98.47 -163.45 1.04 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.916 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.4 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 4.9 p -148.58 157.09 43.22 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.449 ' OG ' ' HB3' ' A' ' 76' ' ' CYS . 2.6 m -62.23 -24.04 67.01 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.324 0.583 . . . . 0.0 111.188 -171.259 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -62.43 -20.06 64.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.255 177.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.3 p -128.07 -25.54 3.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -176.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.1 p -106.12 -171.91 1.99 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.732 0.301 . . . . 0.0 111.47 -175.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -107.63 17.36 22.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.432 -175.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -69.02 121.46 16.71 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.39 -40.15 27.04 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.043 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -101.97 85.18 2.64 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.102 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.449 ' HB3' ' OG ' ' A' ' 68' ' ' SER . 19.0 p -47.93 114.35 0.9 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.588 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASN . . . . . 0.583 ' HB2' ' HB2' ' A' ' 64' ' ' SER . 75.2 m-20 -87.35 -6.79 58.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.936 175.66 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.4 ' OD1' ' HA ' ' A' ' 67' ' ' CYS . 12.9 m120 -82.06 116.55 21.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.604 176.083 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.5 tp -61.09 -55.19 35.5 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.5 mp -86.93 87.72 7.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.566 172.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -72.06 148.97 45.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.023 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.54 -9.06 75.07 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 -171.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.437 ' CB ' ' HD2' ' A' ' 98' ' ' TYR . 74.9 m-85 -123.13 168.05 12.89 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -127.95 150.97 75.02 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 172.062 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.401 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 57.4 Cg_endo -74.35 142.5 30.15 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 122.09 1.86 . . . . 0.0 111.391 174.858 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.515 ' HB3' ' CE1' ' A' ' 99' ' ' TYR . 25.2 pttm -140.31 153.46 46.46 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.299 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.9 mt -84.92 142.82 29.4 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.624 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.1 m -136.2 148.63 27.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.077 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.529 HG22 ' HE1' ' A' ' 49' ' ' MET . 4.5 t -103.64 114.12 42.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.355 0.598 . . . . 0.0 110.263 176.092 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -114.43 96.17 5.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.647 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.82 -112.28 3.88 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.585 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -117.46 16.09 14.69 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.143 0.497 . . . . 0.0 110.278 176.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 15.3 m -124.18 136.95 54.55 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.147 177.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.455 HG12 HG22 ' A' ' 89' ' ' VAL . 58.2 mt -94.51 135.18 29.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.56 178.61 6.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.077 0.465 . . . . 0.0 110.799 -173.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 69.3 mt -118.94 130.26 74.01 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.291 -176.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.401 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 0.0 OUTLIER -126.06 176.38 7.06 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.352 -177.989 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.437 ' HD2' ' CB ' ' A' ' 83' ' ' TYR . 5.0 m-85 -128.71 149.94 50.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.767 0.318 . . . . 0.0 110.736 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.515 ' CE1' ' HB3' ' A' ' 86' ' ' LYS . 51.3 p90 -139.95 152.54 46.42 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.426 ' HG3' ' CE2' ' A' ' 83' ' ' TYR . 2.5 mp0 -61.27 134.2 56.71 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.982 0.42 . . . . 0.0 111.236 -178.351 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.6 t -53.38 123.21 35.02 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.448 175.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.77 -25.52 79.48 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.829 2.352 . . . . 0.0 112.176 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 50.8 t -67.81 -19.95 25.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.871 179.136 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 62.4 tttp . . . . . 0 C--N 1.33 -0.248 0 CA-C-O 121.391 0.615 . . . . 0.0 109.882 178.168 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.618 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 2.4 p-10 . . . . . 0 CA--C 1.52 -0.206 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -49.6 -49.58 46.2 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.457 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -66.09 -33.26 75.37 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.681 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 26.0 mmtp -73.55 -29.44 62.44 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.618 ' HG2' ' O ' ' A' ' 16' ' ' ASP . 13.7 mmm-85 -68.37 -46.47 69.99 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 172.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.7 tp -55.57 -48.88 74.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.116 177.053 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -65.56 -39.14 91.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.017 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.52 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 32.3 tp60 -63.76 -52.1 61.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.764 -177.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.518 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.8 ptm -66.63 -38.28 86.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.48 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -59.46 -44.22 93.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.178 0.513 . . . . 0.0 109.931 177.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.466 ' HA ' ' HG2' ' A' ' 29' ' ' MET . 33.1 tt0 -67.07 -44.41 80.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.318 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -52.29 -51.01 61.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.215 177.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 24' ' ' MET . 85.5 t -59.06 -41.82 84.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.944 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.466 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 21.7 ptp -85.52 14.91 4.99 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -176.113 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.414 ' HD3' ' HG2' ' A' ' 26' ' ' GLU . 3.6 mptp? -119.45 -2.33 10.58 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 176.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.681 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 29.6 t70 -85.3 135.11 34.05 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.617 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.52 ' HG3' ' N ' ' A' ' 33' ' ' ASP . 5.1 pt20 -63.34 -41.16 98.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.073 -176.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.52 ' N ' ' HG3' ' A' ' 32' ' ' GLN . 11.9 m-20 -74.12 -33.1 63.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.022 0.439 . . . . 0.0 110.001 -175.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.13 -43.9 93.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.047 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.681 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 71.2 mm-40 -56.44 -50.32 72.02 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.269 0.557 . . . . 0.0 110.496 177.614 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -56.9 -45.66 82.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.424 -178.061 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -67.34 -41.35 85.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.136 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.456 HD11 HD11 ' A' ' 50' ' ' ILE . 1.9 mm? -57.82 -43.83 86.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.449 -178.514 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.544 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.6 ptmm? -82.8 -22.04 34.33 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.753 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 1.1 tm-20 -65.92 -39.56 90.66 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.193 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -116.81 32.48 6.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.843 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.544 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 10.7 pt-20 -61.43 -22.5 65.08 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.073 0.463 . . . . 0.0 111.181 -178.028 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -77.62 -34.63 53.29 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 177.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.3 t -93.29 -39.36 10.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.394 -171.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.532 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 76.1 mt -71.61 142.97 14.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.24 0.543 . . . . 0.0 111.434 -174.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -120.81 166.02 14.34 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.031 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 57.4 mt-30 -57.69 -44.17 85.63 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.241 0.543 . . . . 0.0 109.963 174.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -63.71 -38.33 90.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.029 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.532 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 50.7 ttm -57.01 -39.16 74.19 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.255 177.144 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.456 HD11 HD11 ' A' ' 38' ' ' LEU . 45.7 mm -67.27 -42.06 87.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.879 178.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 42.7 mm-40 -66.88 -43.28 83.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.129 0.49 . . . . 0.0 110.417 -178.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -67.57 -30.24 69.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.3 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.501 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.5 m -109.0 19.1 19.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.262 -175.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 mt -59.76 -46.6 88.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.053 0.454 . . . . 0.0 110.427 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -57.73 -39.84 78.24 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.856 176.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.576 ' O ' HD11 ' A' ' 96' ' ' ILE . 4.9 mmpt? -67.66 -51.05 54.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.139 0.495 . . . . 0.0 110.283 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 53' ' ' SER . 90.3 mt -62.24 -41.65 98.61 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.127 -177.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -69.49 -43.97 72.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.414 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.574 ' HG3' ' NE2' ' A' ' 63' ' ' GLN . 11.1 tp10 -56.44 -39.38 73.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.135 0.493 . . . . 0.0 109.892 175.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.442 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 56.2 t80 -56.52 -52.61 64.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.917 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.54 ' HA ' ' HD3' ' A' ' 65' ' ' LYS . 32.9 pt -75.53 -30.57 22.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -77.61 -19.62 55.25 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 111.283 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.574 ' NE2' ' HG3' ' A' ' 59' ' ' GLU . 46.0 mt-30 -78.79 -171.54 2.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.163 0.506 . . . . 0.0 110.756 175.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.2 p -75.64 99.74 4.41 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.423 178.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.54 ' HD3' ' HA ' ' A' ' 61' ' ' ILE . 12.3 mmmm -63.78 -26.49 68.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.206 0.527 . . . . 0.0 110.265 176.645 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.539 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.5 t-20 -112.63 -165.65 1.01 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.568 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -148.09 154.53 40.33 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.902 178.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.657 ' HA ' ' O ' ' A' ' 71' ' ' SER . 25.6 t -67.78 -20.62 65.22 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.236 -175.374 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.416 ' HB2' ' HA2' ' A' ' 82' ' ' GLY . 8.2 t80 -69.44 -13.67 62.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 111.601 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.539 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 24.6 p -123.33 -33.69 3.22 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.696 -0.401 . . . . 0.0 110.534 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.657 ' O ' ' HA ' ' A' ' 68' ' ' SER . 39.5 m -125.29 103.79 8.13 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -85.66 61.24 6.73 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.904 0.859 . . . . 0.0 110.614 -173.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -85.37 139.42 31.58 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.511 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -86.54 -21.76 26.73 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.656 -174.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -90.28 -34.02 15.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.694 0.283 . . . . 0.0 111.228 -174.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.67 120.41 11.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.109 0.481 . . . . 0.0 111.496 -178.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -77.64 92.89 4.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.551 ' OD1' ' HA ' ' A' ' 81' ' ' GLU . 2.4 t-20 -100.43 117.9 35.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.715 178.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.1 mt -74.06 -74.46 0.19 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.466 -176.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.0 mp -85.57 96.78 9.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 174.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.619 ' HG3' ' HB3' ' A' ' 68' ' ' SER . 30.7 tt0 -72.62 124.71 25.82 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.176 0.512 . . . . 0.0 110.173 -177.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.416 ' HA2' ' HB2' ' A' ' 69' ' ' TYR . . . 103.88 -7.74 49.45 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.333 -176.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.576 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 15.5 m-85 -121.37 162.01 21.12 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 178.075 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -124.68 150.88 66.69 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 173.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.435 ' HB2' ' CD1' ' A' ' 60' ' ' TYR . 55.5 Cg_endo -71.39 141.44 38.81 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.672 2.248 . . . . 0.0 111.536 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.611 ' HB2' ' CD1' ' A' ' 99' ' ' TYR . 86.4 tttt -131.47 131.14 43.27 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.568 -172.281 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.476 HD12 ' HA ' ' A' ' 87' ' ' LEU . 0.4 OUTLIER -85.76 125.98 33.65 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.254 177.429 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.619 HG11 ' HG3' ' A' ' 97' ' ' GLU . 29.5 m -131.26 145.21 35.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.668 0.271 . . . . 0.0 110.882 178.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.4 p -95.52 120.42 44.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.259 0.552 . . . . 0.0 110.024 176.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -121.96 96.3 5.0 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.866 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.65 -104.31 1.59 Allowed Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.151 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -116.57 5.71 13.34 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.565 0.221 . . . . 0.0 111.175 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.1 p -130.01 159.86 35.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.975 0.417 . . . . 0.0 111.35 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.9 mt -110.28 137.9 40.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.92 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.508 ' HA ' ' HD3' ' A' ' 56' ' ' LYS . 1.8 t0 -126.97 178.92 5.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.879 0.371 . . . . 0.0 110.63 -175.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.576 HD11 ' O ' ' A' ' 56' ' ' LYS . 44.8 mt -123.1 112.61 34.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.195 -176.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.619 ' HG3' HG11 ' A' ' 88' ' ' VAL . 3.7 mm-40 -98.61 -175.11 2.98 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.272 174.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.576 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 3.3 m-85 -139.67 124.03 18.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 174.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.611 ' CD1' ' HB2' ' A' ' 86' ' ' LYS . 39.0 p90 -110.41 147.02 34.85 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 176.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.538 ' H ' ' CD ' ' A' ' 100' ' ' GLU . 2.3 pm0 -66.44 135.06 53.73 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.478 0.656 . . . . 0.0 110.713 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.457 ' SG ' HG12 ' A' ' 103' ' ' VAL . 21.3 t -44.52 124.67 4.75 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 114.195 -1.366 . . . . 0.0 111.857 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -59.32 -10.23 10.34 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 123.339 2.693 . . . . 0.0 113.435 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.457 HG12 ' SG ' ' A' ' 101' ' ' CYS . 8.7 p -66.57 -18.33 23.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.035 0.445 . . . . 0.0 110.625 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.412 ' HD2' ' HA ' ' A' ' 104' ' ' LYS . 13.1 mmmm . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.894 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.426 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 11.4 m-20 . . . . . 0 CA--C 1.522 -0.131 0 CA-C-O 120.478 0.18 . . . . 0.0 111.263 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.81 -51.71 67.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.142 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.42 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -70.66 -31.18 68.01 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.313 -177.79 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.462 ' HE3' ' HB3' ' A' ' 19' ' ' LYS . 21.1 mtpp -66.59 -48.77 68.49 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.966 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.506 ' O ' ' HG2' ' A' ' 24' ' ' MET . 7.2 ptm180 -68.47 -31.69 71.16 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 37.2 tp -62.86 -50.28 71.53 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -59.66 -45.13 92.95 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 120.952 0.406 . . . . 0.0 110.31 176.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -59.1 -57.76 11.62 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.385 -175.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.506 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 25.3 ptm -66.74 -38.3 86.39 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.39 -177.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 25' ' ' LYS . 17.0 tptm -64.81 -41.46 95.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.004 0.431 . . . . 0.0 110.292 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.526 ' HG3' ' HD3' ' A' ' 30' ' ' LYS . 23.4 tt0 -61.83 -50.63 71.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.557 177.004 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -54.41 -42.27 70.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.303 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 24' ' ' MET . 87.0 t -68.87 -42.75 82.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.968 0.413 . . . . 0.0 110.953 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 44.4 mtt -78.69 -6.93 57.09 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -175.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.526 ' HD3' ' HG3' ' A' ' 26' ' ' GLU . 2.1 mptm? -103.26 -4.08 24.78 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -178.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.703 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 25.2 t70 -83.41 134.0 34.9 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.843 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -66.25 -41.34 90.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.851 -175.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -74.32 -35.49 63.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.776 0.322 . . . . 0.0 110.393 -174.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.8 t -55.67 -47.65 78.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.774 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.703 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 35.1 mt-30 -65.02 -31.75 73.13 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.155 0.502 . . . . 0.0 110.88 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.34 -46.49 88.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.464 176.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -65.52 -42.35 92.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.407 176.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.434 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.8 mm? -57.36 -44.43 84.35 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.703 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -73.75 -28.18 61.55 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.923 -177.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -66.47 -55.71 14.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.619 0.723 . . . . 0.0 110.474 178.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -102.47 30.23 4.74 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.627 -174.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -60.4 -27.41 67.43 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.124 -177.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -85.79 -24.1 26.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.885 0.374 . . . . 0.0 111.122 -179.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 22.0 t -93.4 -35.15 6.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.277 0.56 . . . . 0.0 111.147 -172.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.48 HG23 ' HE2' ' A' ' 49' ' ' MET . 50.7 mt -88.27 150.99 3.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.522 -178.004 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -119.34 163.2 17.53 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 29.9 mm-40 -59.61 -39.06 82.98 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.606 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -64.52 -38.05 89.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.045 0.45 . . . . 0.0 110.554 178.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.48 ' HE2' HG23 ' A' ' 45' ' ' ILE . 2.1 ttp -67.43 -31.93 72.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.224 178.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.0 mm -63.69 -46.39 94.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.256 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 9.7 mm-40 -67.37 -40.46 85.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.74 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -66.68 -43.52 84.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.02 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.401 ' HB2' HD12 ' A' ' 94' ' ' ILE . 50.6 m -98.98 19.31 15.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.002 -178.2 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 42.8 tp -63.06 -30.12 71.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -61.83 -38.08 86.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.02 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 17.1 mmtm -74.95 -40.64 60.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.321 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.09 -41.06 97.8 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.331 0.586 . . . . 0.0 110.167 175.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -69.62 -44.47 70.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.539 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.487 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 45.3 tt0 -64.13 -35.4 80.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.344 178.111 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.541 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 26.3 t80 -56.15 -56.1 25.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.369 177.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.1 pt -69.31 -30.99 47.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.09 -174.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 11.0 pt-20 -80.53 -24.97 38.95 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.142 -0.623 . . . . 0.0 112.241 -174.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 58.5 mt-30 -77.76 -32.4 52.6 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.833 -176.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.455 ' OG ' ' HB2' ' A' ' 78' ' ' ASN . 10.9 m -178.84 118.37 0.07 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.047 -175.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.71 -51.79 6.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.8 0.81 . . . . 0.0 109.088 169.097 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.412 ' HB2' ' SG ' ' A' ' 70' ' ' CYS . 30.7 p30 -115.71 -157.81 0.66 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.948 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.482 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 8.2 p -152.62 163.55 39.41 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 44.4 t -54.92 -31.13 59.94 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 123.829 0.706 . . . . 0.0 111.286 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.458 ' HB2' ' HA2' ' A' ' 82' ' ' GLY . 0.1 OUTLIER -75.36 4.97 6.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.286 -0.416 . . . . 0.0 112.036 -178.656 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 66' ' ' ASN . 31.9 p -151.64 19.25 0.71 Allowed 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.141 0.496 . . . . 0.0 110.352 175.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.6 t -129.65 153.38 48.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.414 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.5 tp10 -77.44 -27.1 52.05 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -84.6 129.25 34.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.349 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.96 -4.86 5.06 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.564 174.013 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -75.51 -40.56 56.93 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.209 -175.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 26.4 p -152.07 26.18 0.62 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.866 0.365 . . . . 0.0 110.934 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -68.89 -60.44 2.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.253 -173.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.482 ' OD1' ' HA ' ' A' ' 67' ' ' CYS . 1.3 p-10 -160.97 156.98 25.61 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.28 -0.418 . . . . 0.0 109.928 -177.186 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -74.06 -56.81 4.48 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.789 0.328 . . . . 0.0 111.161 -174.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 29.1 mt -82.29 81.25 8.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.43 0.633 . . . . 0.0 111.058 -176.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -64.59 129.34 39.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.767 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . 0.458 ' HA2' ' HB2' ' A' ' 69' ' ' TYR . . . 97.52 -9.02 64.47 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.346 178.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.73 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 44.7 m-85 -125.0 157.93 34.94 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 111.394 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.451 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 2.7 m80 -129.61 155.29 80.51 Favored Pre-proline 0 CA--C 1.51 -0.59 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 171.121 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.541 ' O ' ' HE1' ' A' ' 60' ' ' TYR . 38.2 Cg_endo -77.81 151.61 28.17 Favored 'Trans proline' 0 N--CA 1.446 -1.318 0 C-N-CA 122.096 1.864 . . . . 0.0 110.717 172.386 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 31.5 ttpt -144.83 141.35 29.07 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 176.274 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.466 HD22 ' H ' ' A' ' 87' ' ' LEU . 1.8 mm? -78.7 140.01 38.4 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 32.2 m -132.26 147.84 32.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 175.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 p -98.17 114.4 35.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.406 0.622 . . . . 0.0 110.298 178.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -117.42 96.32 5.35 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.556 178.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.83 -107.38 2.07 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.066 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -116.96 19.16 14.46 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.218 0.533 . . . . 0.0 110.482 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.8 p -135.42 141.77 45.5 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.234 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.401 HD12 ' HB2' ' A' ' 53' ' ' SER . 68.1 mt -96.54 131.84 42.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.116 178.65 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -120.48 178.13 4.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.636 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 70.8 mt -132.93 114.53 22.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.851 0.357 . . . . 0.0 110.934 -176.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 9.4 pt-20 -103.13 -177.05 3.26 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.3 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.73 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 2.9 m-85 -130.25 123.61 30.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.107 0.48 . . . . 0.0 110.587 175.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.467 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 51.2 p90 -112.75 151.88 29.77 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 176.548 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.412 ' HA ' ' HA ' ' A' ' 83' ' ' TYR . 5.4 pt-20 -84.42 133.26 34.51 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.744 0.783 . . . . 0.0 111.467 -178.15 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 6.6 t -46.8 123.49 7.65 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.803 -178.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.93 -10.79 29.7 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.801 2.334 . . . . 0.0 112.442 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 59.6 t -69.0 -20.44 24.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.925 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 101' ' ' CYS . 22.3 ptmt . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.683 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 120.682 0.277 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -54.58 -56.16 21.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.685 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.531 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 25.7 pt20 -71.5 -30.29 65.79 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.733 -177.218 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 29.9 mtpp -59.01 -47.92 83.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.533 178.093 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.403 ' HD3' HH11 ' A' ' 20' ' ' ARG . 19.7 ptt180 -77.49 -29.98 52.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.694 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.531 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 23.5 tp -61.1 -50.02 74.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.899 179.295 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 21.8 mm-40 -75.68 -27.2 58.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.097 178.438 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 34.1 tt0 -62.25 -54.87 34.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.931 0.396 . . . . 0.0 110.551 178.04 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.499 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.3 ptm -65.67 -36.99 85.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.025 177.211 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.422 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 11.7 tptm -54.3 -49.33 69.91 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.695 175.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -60.14 -48.3 82.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.996 -175.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -57.34 -40.3 77.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.111 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 24' ' ' MET . 60.7 t -70.96 -33.89 53.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.168 0.509 . . . . 0.0 110.393 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.5 mmt -71.03 -14.01 62.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.125 -176.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.77 14.51 12.56 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.693 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 18.3 t70 -85.31 135.48 33.89 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.549 176.306 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -63.99 -47.31 80.84 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.83 -175.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -70.48 -34.04 71.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.893 0.377 . . . . 0.0 110.405 -175.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 76.4 t -58.59 -43.23 86.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.761 174.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.693 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 61.9 mm-40 -59.59 -49.06 79.22 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.171 0.51 . . . . 0.0 110.527 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.52 -43.48 75.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.609 -177.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.505 ' CE2' HD11 ' A' ' 45' ' ' ILE . 78.3 t80 -72.28 -40.98 67.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.057 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.92 HD11 HD11 ' A' ' 50' ' ' ILE . 1.9 mm? -60.11 -45.54 92.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.538 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -73.71 -26.15 60.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.536 -178.302 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -66.35 -54.92 18.97 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.384 0.612 . . . . 0.0 110.307 176.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -105.69 32.64 4.2 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.483 -173.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -62.43 -24.45 67.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.944 0.402 . . . . 0.0 111.178 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -68.5 -36.42 78.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.336 0.588 . . . . 0.0 110.011 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 15.4 t -93.9 -43.21 13.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.83 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.505 HD11 ' CE2' ' A' ' 37' ' ' PHE . 67.9 mt -75.63 144.21 12.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.864 -176.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -131.25 176.72 8.04 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.413 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 99.3 mt-30 -59.74 -39.93 86.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.763 0.316 . . . . 0.0 111.82 -177.446 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -72.8 -36.8 67.66 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.935 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.484 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 53.6 ttm -56.47 -36.58 69.25 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 174.012 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.92 HD11 HD11 ' A' ' 38' ' ' LEU . 37.2 mm -61.48 -54.71 31.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.996 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.734 ' HA ' HD23 ' A' ' 54' ' ' LEU . 29.7 mt-10 -68.82 -34.6 75.78 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -178.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.4 tptp -65.02 -26.54 68.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.906 0.384 . . . . 0.0 110.525 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -115.2 16.36 16.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.38 -178.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.734 HD23 ' HA ' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -58.83 -41.16 86.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.613 -178.685 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -55.48 -43.77 75.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.436 176.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.505 ' O ' HD11 ' A' ' 96' ' ' ILE . 33.2 mmtp -71.49 -48.38 49.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.861 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.57 -42.26 87.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.034 0.445 . . . . 0.0 110.753 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -70.08 -39.44 75.59 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.423 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.01 -40.13 92.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.038 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.457 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 70.0 t80 -63.25 -50.49 69.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.979 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.1 pt -70.28 -31.27 46.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -171.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -85.38 -25.67 26.92 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.335 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.457 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 0.8 OUTLIER -75.06 160.99 29.83 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.603 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.9 p -64.1 120.52 12.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.696 0.284 . . . . 0.0 111.39 -176.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HD3' ' O ' ' A' ' 65' ' ' LYS . 3.0 tmtp? -73.64 -31.74 63.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.526 0.679 . . . . 0.0 109.168 177.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -84.73 -165.4 1.17 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.215 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 p -157.8 159.85 37.17 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 176.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.446 ' HB2' ' HB2' ' A' ' 76' ' ' CYS . 22.8 t -67.42 -23.43 65.55 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.054 0.454 . . . . 0.0 110.509 -172.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -68.1 -9.09 43.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.696 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.2 p -133.42 1.24 3.42 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 28.8 m -122.64 140.51 52.75 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -81.09 57.3 3.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.928 0.87 . . . . 0.0 110.407 -177.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -154.32 124.71 6.95 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.231 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -100.35 0.16 39.47 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.357 -176.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -88.45 53.24 2.66 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.035 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.467 ' SG ' ' HB3' ' A' ' 78' ' ' ASN . 49.7 t -84.55 129.98 34.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.59 -1.187 . . . . 0.0 111.154 -172.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -80.13 -17.42 52.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.001 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.467 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 39.0 t30 -57.97 136.86 57.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.508 -177.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.7 mt -81.86 -56.52 3.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.859 -179.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.417 ' HB2' ' CE2' ' A' ' 98' ' ' TYR . 3.9 mm? -85.34 79.36 9.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.715 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -73.5 138.71 45.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.562 0.696 . . . . 0.0 110.67 -176.077 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.55 -8.58 68.91 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.956 -171.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.462 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 74.4 m-85 -122.78 168.91 11.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 178.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.415 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 1.1 m80 -128.41 149.12 70.69 Favored Pre-proline 0 C--O 1.236 0.383 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 170.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -70.74 142.67 44.14 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.78 2.32 . . . . 0.0 112.866 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.484 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 16.6 ttmm -133.48 137.19 45.55 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.179 177.099 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.1 mt -83.66 130.63 34.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.198 176.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.425 HG21 ' HG2' ' A' ' 97' ' ' GLU . 16.0 m -132.11 149.86 33.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.48 178.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.6 p -97.64 118.03 43.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.201 0.524 . . . . 0.0 110.697 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -122.31 98.04 5.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.014 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.53 -112.01 4.58 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.995 -177.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.46 ' HD3' ' HE2' ' A' ' 49' ' ' MET . 17.7 mmt180 -112.6 15.49 20.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.155 0.503 . . . . 0.0 110.512 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.9 p -125.78 131.12 52.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.075 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.5 mt -91.04 129.16 42.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -119.27 177.83 4.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.952 0.406 . . . . 0.0 110.847 -170.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.505 HD11 ' O ' ' A' ' 56' ' ' LYS . 56.5 mt -127.7 106.87 15.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.587 -177.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.425 ' HG2' HG21 ' A' ' 88' ' ' VAL . 57.3 mm-40 -97.31 178.9 5.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.433 176.086 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 80' ' ' LEU . 24.4 m-85 -132.16 130.71 41.45 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.159 0.504 . . . . 0.0 111.12 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.484 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 38.0 p90 -113.41 150.87 32.1 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.381 174.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.462 ' HG2' ' CE1' ' A' ' 83' ' ' TYR . 36.8 mt-10 -64.62 131.48 47.1 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.657 0.265 . . . . 0.0 110.907 -177.203 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.518 ' SG ' HG12 ' A' ' 103' ' ' VAL . 47.7 t -44.63 122.56 4.54 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.889 177.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.53 -12.67 21.82 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 123.241 2.627 . . . . 0.0 113.849 -175.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.518 HG12 ' SG ' ' A' ' 101' ' ' CYS . 4.5 p -67.77 -19.02 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 120.765 0.316 . . . . 0.0 110.525 178.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.2 mttt . . . . . 0 C--O 1.231 0.109 0 CA-C-O 121.068 0.461 . . . . 0.0 110.515 177.19 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.55 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 2.1 p-10 . . . . . 0 C--O 1.232 0.165 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -55.48 -53.06 61.06 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.539 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -63.66 -31.23 72.33 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.888 -177.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.55 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 43.1 mtmt -64.36 -36.67 84.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.576 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.466 ' O ' ' HG2' ' A' ' 24' ' ' MET . 8.6 mtt180 -71.77 -50.65 28.05 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.457 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.8 tp -54.21 -49.64 68.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.049 -175.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -74.67 -34.58 62.71 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.97 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 46.8 tt0 -63.44 -56.19 18.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.777 0.323 . . . . 0.0 110.862 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.608 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.4 ptm -61.7 -37.64 84.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.747 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.551 ' HA ' ' HE3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -66.93 -44.55 80.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.154 178.707 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -65.03 -37.21 86.86 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -58.06 -44.16 87.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.698 175.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 24' ' ' MET . 78.1 t -64.62 -36.08 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.956 178.17 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.456 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 88.9 mmm -84.97 0.14 52.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.071 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.87 -35.99 13.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.436 0.636 . . . . 0.0 110.331 175.27 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.692 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 21.7 t70 -62.56 123.49 18.48 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.154 -171.307 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.439 ' H ' ' CD ' ' A' ' 32' ' ' GLN . 18.0 mp0 -60.65 -41.25 94.6 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.395 -176.547 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -63.12 -46.85 85.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.918 -177.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.8 t -54.93 -47.11 76.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.404 176.12 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.692 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 55.5 mt-30 -62.31 -40.63 96.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.5 -176.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.54 -40.26 82.49 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.562 177.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.459 ' CE2' HD11 ' A' ' 45' ' ' ILE . 88.5 t80 -69.56 -39.79 77.18 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.397 177.274 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.579 HD11 HD11 ' A' ' 50' ' ' ILE . 2.6 mm? -63.08 -44.91 94.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.756 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -68.51 -29.12 67.65 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.104 0.478 . . . . 0.0 110.527 -177.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.47 -30.42 37.43 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.987 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -119.14 26.55 9.41 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -65.4 -17.64 64.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.097 0.475 . . . . 0.0 110.18 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.84 -31.76 69.81 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.118 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.5 t -108.19 -35.43 2.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.492 -172.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.459 HD11 ' CE2' ' A' ' 37' ' ' PHE . 68.9 mt -78.3 135.67 25.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.558 0.694 . . . . 0.0 111.516 -175.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -111.44 164.98 12.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.74 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.401 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 76.7 mt-30 -61.51 -37.23 82.94 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.347 0.594 . . . . 0.0 109.658 173.275 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -63.07 -42.2 99.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.276 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 33.6 tpp -56.21 -42.29 76.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.289 176.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.579 HD11 HD11 ' A' ' 38' ' ' LEU . 35.9 mm -60.32 -39.35 80.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.517 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.516 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 41.8 mt-10 -65.58 -49.19 69.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.487 176.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -60.65 -47.16 87.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.14 -177.027 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.3 p -92.79 17.66 10.1 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.329 -175.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.516 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -52.45 -49.37 64.76 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.96 0.409 . . . . 0.0 110.786 -179.473 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -61.74 -42.32 98.81 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.681 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -61.15 -51.36 69.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.806 0.336 . . . . 0.0 110.388 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 57' ' ' LEU . 3.9 mm? -59.95 -43.31 95.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.054 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -66.21 -42.62 88.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.411 -177.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -59.59 -36.43 76.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.352 0.596 . . . . 0.0 110.021 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -67.23 -45.38 76.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.885 -178.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.6 pt -75.36 -31.4 23.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -174.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -81.07 -27.05 35.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.589 0.233 . . . . 0.0 111.29 -177.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -80.25 173.99 12.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.055 0.455 . . . . 0.0 111.117 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.6 m -76.7 116.04 17.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.704 -179.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -81.02 -35.76 31.47 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.129 0.49 . . . . 0.0 110.111 176.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -79.86 -177.02 5.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.952 177.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -150.79 156.81 42.02 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.632 -177.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.492 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 33.1 t -66.98 -19.01 65.65 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.223 -172.709 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.483 ' CE1' ' HA ' ' A' ' 104' ' ' LYS . 1.2 t80 -75.9 -2.23 29.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.066 0.46 . . . . 0.0 111.305 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 17.6 p -132.24 -44.28 0.94 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.559 176.012 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.6 p -80.53 152.09 28.84 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -81.97 -9.79 59.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.818 0.342 . . . . 0.0 110.768 -176.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASP . . . . . 0.482 ' HB2' ' HB2' ' A' ' 76' ' ' CYS . 7.4 m-20 -55.0 111.82 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.222 -175.161 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -70.4 -21.74 62.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.449 0.643 . . . . 0.0 109.273 171.607 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -86.98 4.84 40.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.563 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' CYS . . . . . 0.482 ' HB2' ' HB2' ' A' ' 73' ' ' ASP . 45.8 t -69.3 114.37 7.48 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.07 0.462 . . . . 0.0 110.506 -178.211 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -117.22 143.85 45.43 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -160.49 168.41 25.15 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.0 mt -75.26 -79.22 0.1 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 8.0 mp -88.34 93.86 9.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.206 173.296 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.492 ' CD ' ' H ' ' A' ' 68' ' ' SER . 2.2 mm-40 -76.19 151.52 36.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.354 0.597 . . . . 0.0 110.714 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.38 -9.74 72.01 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.028 -170.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.559 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 64.9 m-85 -122.47 172.12 8.59 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.491 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 1.2 m80 -128.92 144.35 52.19 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 172.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -75.34 130.76 13.22 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.446 2.097 . . . . 0.0 111.252 174.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.557 ' HD3' ' CD1' ' A' ' 99' ' ' TYR . 19.9 pttp -134.99 148.5 49.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.007 0.432 . . . . 0.0 109.994 175.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.415 HD23 HG12 ' A' ' 96' ' ' ILE . 73.2 mt -81.26 141.62 33.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.346 -175.663 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.7 m -135.95 154.23 33.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.562 175.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.6 p -107.05 114.02 45.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.343 0.592 . . . . 0.0 110.346 176.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -125.89 101.97 7.07 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.302 -177.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.73 -118.5 9.86 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.211 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 92' ' ' ARG . 20.7 tpp180 -105.2 19.52 20.45 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.978 0.894 . . . . 0.0 109.947 -179.334 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 43.3 t -136.16 136.53 40.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.25 0.548 . . . . 0.0 111.433 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 86.3 mt -89.61 119.54 36.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 169.718 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.57 177.71 4.54 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.852 0.358 . . . . 0.0 110.634 -172.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.415 HG12 HD23 ' A' ' 87' ' ' LEU . 53.3 mt -131.64 115.98 29.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.309 -177.262 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -119.03 163.28 17.21 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 174.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.559 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 30.3 m-85 -103.92 141.21 36.55 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.096 -176.437 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.557 ' CD1' ' HD3' ' A' ' 86' ' ' LYS . 53.6 p90 -117.69 147.55 42.81 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 173.08 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.479 ' HG2' ' CE2' ' A' ' 83' ' ' TYR . 31.5 mt-10 -62.58 125.83 25.27 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.395 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.619 ' HB3' ' HB2' ' A' ' 104' ' ' LYS . 40.0 t -47.31 132.43 9.82 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.235 175.193 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -55.58 -29.29 69.26 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 122.537 2.158 . . . . 0.0 112.085 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.0 t -80.16 -17.9 12.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.38 178.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.619 ' HB2' ' HB3' ' A' ' 101' ' ' CYS . 14.2 tmtt? . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.524 -179.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.707 0.289 . . . . 0.0 110.892 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -55.85 -50.54 70.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.395 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -34.3 70.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.895 0.378 . . . . 0.0 110.184 -176.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -62.47 -47.63 83.14 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.776 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.508 ' O ' ' HG2' ' A' ' 24' ' ' MET . 12.7 ptm180 -72.57 -32.34 65.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.563 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.632 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 36.4 tp -64.85 -50.28 67.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.152 -178.326 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -67.02 -29.92 69.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.272 0.558 . . . . 0.0 110.309 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -67.69 -54.75 16.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.5 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 25.7 ptm -68.66 -34.63 76.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.068 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.632 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 12.3 tptm -56.69 -51.79 67.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.312 0.577 . . . . 0.0 110.308 178.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.48 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 41.2 tt0 -65.41 -36.33 83.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.647 -179.06 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.402 ' HE3' ' CE1' ' A' ' 58' ' ' TYR . 18.7 mtpp -62.94 -36.45 83.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.731 178.249 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 24' ' ' MET . 95.9 t -70.73 -38.55 73.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.178 0.513 . . . . 0.0 109.738 177.029 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 25.9 mmt -77.36 5.27 9.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.042 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 1.9 mptp? -101.53 -13.7 17.78 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.775 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.675 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 35.5 t70 -85.6 142.59 29.0 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.257 0.551 . . . . 0.0 111.927 -172.018 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -72.48 -44.2 62.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.463 -176.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -67.8 -38.56 83.46 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 -178.232 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.424 ' O ' HD23 ' A' ' 38' ' ' LEU . 46.2 t -53.71 -46.54 62.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.873 175.199 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.675 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 59.0 mm-40 -57.92 -52.36 65.8 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.048 0.451 . . . . 0.0 110.852 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.46 97.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.516 -176.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.1 t80 -63.71 -40.05 95.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.635 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.531 HD11 HD11 ' A' ' 50' ' ' ILE . 2.2 mm? -62.13 -49.32 76.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.371 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -66.71 -28.09 68.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.249 0.547 . . . . 0.0 110.804 -177.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.44 -33.33 54.82 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.563 -178.017 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -119.16 25.67 10.0 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.393 -175.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -70.0 -17.02 63.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.636 0.255 . . . . 0.0 111.616 -175.081 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -71.79 -39.89 69.58 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.1 t -93.41 -41.44 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.737 -172.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.493 HG12 ' SD ' ' A' ' 49' ' ' MET . 64.9 mt -92.92 141.74 14.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.029 -176.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.49 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -131.54 -179.21 5.23 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.12 -36.85 80.84 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.539 0.2 . . . . 0.0 111.539 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -62.27 -48.74 78.6 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.653 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.493 ' SD ' HG12 ' A' ' 45' ' ' ILE . 44.5 ttm -60.1 -35.97 76.38 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.774 178.007 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.531 HD11 HD11 ' A' ' 38' ' ' LEU . 36.6 mm -63.53 -47.8 89.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.056 178.395 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -70.37 -30.56 67.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.951 0.405 . . . . 0.0 110.766 -178.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.474 ' N ' ' HE3' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -75.49 -40.9 56.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.041 179.189 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.461 ' HB2' HD12 ' A' ' 94' ' ' ILE . 15.4 m -95.87 21.3 8.74 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.475 178.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.2 tp -59.13 -40.75 86.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.408 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -59.68 -41.55 90.94 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.363 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.515 ' O ' HD11 ' A' ' 96' ' ' ILE . 73.7 mmtt -64.01 -53.44 49.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.759 178.631 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.405 HD11 HG21 ' A' ' 94' ' ' ILE . 11.0 mp -61.06 -39.12 88.66 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.151 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.402 ' CE1' ' HE3' ' A' ' 27' ' ' LYS . 32.3 t80 -67.49 -40.95 85.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.774 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -64.49 -37.8 88.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.342 0.591 . . . . 0.0 109.9 177.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 54.9 t80 -65.33 -47.1 77.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.162 -177.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.552 ' HA ' ' HE3' ' A' ' 65' ' ' LYS . 23.7 pt -70.32 -30.51 43.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 C-N-CA 121.148 -0.221 . . . . 0.0 111.508 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -81.34 -25.19 36.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.795 -179.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 2.2 pt20 -82.51 156.0 24.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.693 -178.65 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 14.5 m -62.48 109.46 1.38 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.455 -177.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.552 ' HE3' ' HA ' ' A' ' 61' ' ' ILE . 93.7 mttt -83.26 -41.0 18.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.911 178.372 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -78.75 171.53 15.02 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.167 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -141.16 154.01 45.65 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -178.452 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.552 ' HB2' ' OE2' ' A' ' 81' ' ' GLU . 72.5 m -74.31 -11.45 60.27 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.507 0.504 . . . . 0.0 111.442 -170.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.21 -0.43 19.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.001 174.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 28.6 p -143.67 -28.19 0.53 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.761 176.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.496 ' O ' ' HA ' ' A' ' 68' ' ' SER . 16.5 m -114.16 151.19 33.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -100.31 7.36 44.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.585 0.231 . . . . 0.0 111.211 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.13 104.36 0.14 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.369 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -83.01 -23.92 33.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.821 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -92.73 29.68 1.72 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.492 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 31.1 p -134.4 126.62 29.93 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 174.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -83.38 120.89 26.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.302 0.572 . . . . 0.0 109.834 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -111.06 109.83 20.1 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.316 0.579 . . . . 0.0 109.879 174.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.5 tt -57.65 -61.41 2.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.108 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.2 mp -86.47 162.95 17.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.574 173.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.552 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 6.8 tp10 -141.07 145.57 36.01 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.57 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.93 6.92 87.51 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -169.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.659 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 78.5 m-85 -134.51 154.98 51.16 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.76 0.314 . . . . 0.0 110.881 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.404 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 0.3 OUTLIER -130.48 146.07 60.18 Favored Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 174.203 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.462 ' CG ' ' HA ' ' A' ' 65' ' ' LYS . 69.7 Cg_endo -78.05 143.16 20.15 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.191 1.927 . . . . 0.0 111.82 174.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -144.15 150.74 38.54 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 176.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 97.5 mt -75.75 137.57 40.67 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.025 176.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.455 HG21 ' OE2' ' A' ' 97' ' ' GLU . 30.2 m -130.58 148.52 33.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 116.28 -0.418 . . . . 0.0 109.931 177.507 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.3 p -87.87 116.27 29.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.555 0.693 . . . . 0.0 109.551 175.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.31 95.88 5.28 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.098 -176.051 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.81 -108.31 2.33 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.849 -176.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -117.67 19.29 13.92 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.306 0.574 . . . . 0.0 109.985 177.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 11.6 p -132.48 160.49 36.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.003 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.461 HD12 ' HB2' ' A' ' 53' ' ' SER . 47.1 mt -104.67 134.65 45.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -125.49 178.14 5.8 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -175.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.515 HD11 ' O ' ' A' ' 56' ' ' LYS . 26.9 mt -130.83 113.71 25.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.882 -178.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.455 ' OE2' HG21 ' A' ' 88' ' ' VAL . 32.8 mt-10 -126.85 159.38 34.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.585 -0.279 . . . . 0.0 110.287 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.659 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 8.0 m-85 -99.31 136.08 39.78 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.981 0.42 . . . . 0.0 112.026 -175.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -115.19 158.62 22.01 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 173.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.91 139.37 43.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.749 0.309 . . . . 0.0 110.614 -175.451 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 33.0 t -55.07 121.82 38.42 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.117 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.61 -9.25 25.56 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.374 2.05 . . . . 0.0 112.576 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 33.4 t -82.01 -13.53 12.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.182 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.9 tptp . . . . . 0 C--N 1.324 -0.504 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.85 -178.354 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.945 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 9.9 t70 . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 120.584 0.23 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -53.26 -55.97 20.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.485 178.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.565 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 18.0 pt20 -66.17 -31.22 71.94 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.739 0.304 . . . . 0.0 110.761 -177.828 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.945 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 50.4 mtpt -58.27 -42.12 85.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.388 177.713 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.707 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 23.2 mtp180 -78.8 -41.36 30.54 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.902 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.565 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 30.1 tp -54.27 -49.75 68.85 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.737 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -75.92 -28.52 58.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.018 0.437 . . . . 0.0 110.759 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.484 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 43.2 tt0 -62.41 -55.27 29.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.913 176.143 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.472 ' O ' HG23 ' A' ' 28' ' ' VAL . 27.1 ptm -62.99 -35.86 81.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.755 -179.194 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.672 ' O ' ' HG2' ' A' ' 29' ' ' MET . 4.1 tppp? -55.82 -53.86 51.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 173.119 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.63 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 2.3 tt0 -55.07 -48.16 73.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.651 178.136 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.442 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 12.5 mmmt -51.84 -42.23 62.43 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.064 178.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.564 ' HA ' HD13 ' A' ' 61' ' ' ILE . 78.6 t -69.89 -37.61 73.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 121.212 0.53 . . . . 0.0 110.3 -177.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.672 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 29.1 mmm -75.23 5.82 5.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.557 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.63 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 30.5 mmtp -102.81 -18.27 15.19 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.657 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 23.1 t70 -81.27 129.28 34.54 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.731 -0.388 . . . . 0.0 111.142 -175.401 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -62.66 -36.58 83.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.826 -0.624 . . . . 0.0 112.2 -175.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -73.74 -36.75 65.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.834 0.35 . . . . 0.0 110.402 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 32.8 t -57.72 -50.09 78.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.406 173.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 45.8 mt-30 -61.32 -41.29 96.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.577 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.433 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -58.86 -40.84 85.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.67 177.033 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -67.79 -41.39 83.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.765 177.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.485 HD11 HD11 ' A' ' 50' ' ' ILE . 1.9 mm? -60.75 -45.37 94.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.366 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -72.87 -25.1 60.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.01 0.433 . . . . 0.0 110.797 -178.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -78.85 -32.13 45.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.683 -177.512 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -122.73 28.33 7.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.278 -178.476 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -62.84 -23.86 67.5 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.935 0.398 . . . . 0.0 111.43 -178.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -70.79 -32.95 70.22 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.289 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.9 t -94.74 -44.53 13.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.926 -172.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.6 mt -79.8 142.87 13.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.328 -174.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -127.95 176.3 7.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.423 175.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.561 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 49.1 mt-30 -58.77 -46.4 87.57 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -177.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -60.01 -40.0 87.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.756 0.312 . . . . 0.0 111.297 -178.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.486 ' HG2' HG13 ' A' ' 94' ' ' ILE . 44.1 ttm -60.06 -43.39 95.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.476 177.271 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.485 HD11 HD11 ' A' ' 38' ' ' LEU . 38.2 mm -62.79 -44.71 99.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.061 178.531 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 13.7 mm-40 -61.89 -36.42 81.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.595 -177.214 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.9 mtmt -75.31 -44.17 46.92 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.793 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.495 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 26.0 m -91.93 19.65 6.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.588 -174.316 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 45.9 tp -62.47 -37.9 87.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.853 0.358 . . . . 0.0 110.317 178.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -62.18 -39.99 94.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.352 176.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.571 ' O ' HD11 ' A' ' 96' ' ' ILE . 70.2 mmtt -61.53 -53.32 57.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.1 0.476 . . . . 0.0 110.885 178.143 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.16 -36.58 84.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.354 -177.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -69.58 -42.42 74.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.796 0.331 . . . . 0.0 110.157 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -56.18 -42.8 77.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.965 175.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.419 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 76.2 t80 -61.52 -46.97 87.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.418 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.564 HD13 ' HA ' ' A' ' 28' ' ' VAL . 36.2 pt -75.38 -31.14 23.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 -175.226 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -84.1 -19.33 34.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.762 0.315 . . . . 0.0 111.078 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -88.08 -178.05 5.88 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 173.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.0 m -71.75 124.62 25.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.118 0.485 . . . . 0.0 111.345 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -78.17 -27.09 47.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.922 174.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -99.92 -164.6 1.14 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.005 175.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.7 p -146.18 156.77 43.64 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 176.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 t -66.0 -13.34 59.69 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.212 0.529 . . . . 0.0 111.12 -173.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -78.49 -3.4 43.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.733 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.4 p -134.77 -38.92 0.8 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.235 176.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.1 p -83.39 130.55 35.05 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 177.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.423 ' H ' ' HG2' ' A' ' 72' ' ' GLU . 7.2 pt-20 -95.98 0.58 51.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.25 0.548 . . . . 0.0 110.989 -176.039 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -75.31 104.22 5.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.374 171.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.92 5.85 20.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.772 -175.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -70.45 -40.18 73.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.913 0.387 . . . . 0.0 110.378 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 72.5 m -86.96 113.62 22.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.593 176.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -105.42 144.58 32.0 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 173.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.678 ' HB3' ' HG ' ' A' ' 80' ' ' LEU . 22.2 m120 -142.13 158.21 44.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.16 -175.186 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.43 -22.14 55.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.367 0.603 . . . . 0.0 109.399 171.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.678 ' HG ' ' HB3' ' A' ' 78' ' ' ASN . 2.6 pp -82.42 126.24 31.98 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.259 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -143.55 118.01 9.7 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.961 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.27 -8.18 68.8 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.844 -176.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.436 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 89.8 m-85 -126.28 162.19 26.04 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.435 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 0.8 OUTLIER -125.92 148.54 63.04 Favored Pre-proline 0 CA--C 1.514 -0.416 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.31 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.419 ' O ' ' HE1' ' A' ' 60' ' ' TYR . 42.2 Cg_endo -69.81 144.27 53.24 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.226 1.951 . . . . 0.0 111.593 175.618 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.478 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 59.9 tttp -146.75 134.15 20.75 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.25 -178.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.408 HD22 ' H ' ' A' ' 87' ' ' LEU . 2.0 mm? -71.74 131.54 43.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 178.737 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.401 HG21 ' HG2' ' A' ' 97' ' ' GLU . 35.1 m -129.13 152.15 36.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.131 177.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -99.15 112.1 30.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.366 0.603 . . . . 0.0 109.55 173.158 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -110.19 96.82 6.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.819 -178.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.36 -99.87 0.68 Allowed Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.527 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -118.63 3.41 11.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.665 0.269 . . . . 0.0 111.405 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.4 t -124.35 150.69 45.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.784 0.326 . . . . 0.0 110.826 -176.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.495 ' HB ' ' CB ' ' A' ' 53' ' ' SER . 66.5 mt -94.33 139.13 19.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 176.041 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -135.57 178.39 7.08 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -175.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.571 HD11 ' O ' ' A' ' 56' ' ' LYS . 65.6 mt -121.16 101.34 10.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.616 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.401 ' HG2' HG21 ' A' ' 88' ' ' VAL . 35.4 mm-40 -95.97 -170.46 2.13 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.672 176.077 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.435 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 43.7 m-85 -133.65 141.89 47.81 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.281 0.562 . . . . 0.0 111.71 -175.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.478 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 46.0 p90 -122.26 151.39 41.13 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.213 172.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.436 ' HG2' ' CE1' ' A' ' 83' ' ' TYR . 41.5 mt-10 -65.77 127.76 33.27 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.193 -177.271 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.47 ' SG ' HG12 ' A' ' 103' ' ' VAL . 49.8 t -48.34 123.31 10.76 Favored Pre-proline 0 N--CA 1.463 0.219 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.482 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -67.83 5.57 1.02 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 123.266 2.644 . . . . 0.0 113.886 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.47 HG12 ' SG ' ' A' ' 101' ' ' CYS . 5.9 p -86.33 -19.54 8.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 O-C-N 122.1 -0.375 . . . . 0.0 110.464 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt . . . . . 0 C--N 1.334 -0.097 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.298 -176.585 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.576 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 6.3 p-10 . . . . . 0 C--O 1.226 -0.133 0 CA-C-O 120.467 0.175 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -53.61 -58.62 6.52 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.702 175.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -71.87 -30.8 65.8 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.768 -178.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.576 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 52.9 mtmt -64.08 -45.55 88.21 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.066 -0.254 . . . . 0.0 110.672 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -71.87 -37.54 70.17 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 178.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.4 tp -63.19 -49.92 72.36 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.946 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.403 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 75.2 mm-40 -65.95 -35.81 81.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.524 177.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -62.52 -59.11 5.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.161 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.43 ' O ' HG23 ' A' ' 28' ' ' VAL . 22.7 ptm -61.63 -40.49 95.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.938 -177.239 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.42 ' O ' ' HG2' ' A' ' 29' ' ' MET . 55.3 tptt -62.0 -43.19 99.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.959 0.409 . . . . 0.0 109.978 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.423 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 3.2 tp10 -60.53 -46.54 89.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.579 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -64.5 -41.81 96.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.171 -176.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 24' ' ' MET . 71.5 t -70.98 -44.51 75.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.082 -175.077 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.466 ' C ' ' HD3' ' A' ' 30' ' ' LYS . 90.6 mmm -71.07 -15.24 62.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.865 0.364 . . . . 0.0 110.805 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HD3' ' C ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -110.48 13.65 22.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.716 -178.761 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.567 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 26.5 t70 -85.41 131.74 34.34 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 170.429 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -61.31 -38.14 85.77 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.419 0.449 . . . . 0.0 111.845 -174.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -71.38 -47.22 57.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.168 0.509 . . . . 0.0 109.669 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.6 t -55.06 -55.13 17.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.496 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.596 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.3 pt20 -65.78 -27.73 68.5 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.529 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.433 ' HA ' ' NZ ' ' A' ' 39' ' ' LYS . . . -62.79 -45.66 91.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.309 0.576 . . . . 0.0 109.739 173.15 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -66.81 -40.78 88.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.711 176.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.666 HD11 HD11 ' A' ' 50' ' ' ILE . 1.6 mm? -58.99 -48.88 79.97 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.949 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' A' ' 35' ' ' GLN . 17.9 pttm -73.55 -24.0 60.06 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.015 -178.021 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.43 -41.26 76.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.118 0.485 . . . . 0.0 110.229 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -115.41 28.99 8.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.526 -174.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -69.2 -14.9 63.24 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.149 0.5 . . . . 0.0 110.62 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.54 -31.22 71.17 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.677 0.751 . . . . 0.0 109.625 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.1 t -106.05 -41.77 6.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.512 -172.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.9 mt -87.32 141.71 13.97 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.761 -171.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.403 ' O ' HG12 ' A' ' 50' ' ' ILE . 5.5 p-10 -124.26 178.07 5.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.361 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.463 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 77.3 mt-30 -58.88 -46.05 88.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.635 0.255 . . . . 0.0 111.156 -178.278 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 27.2 mmtm -68.54 -35.41 77.41 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -174.229 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 51.9 ttm -59.51 -32.06 69.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 171.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.666 HD11 HD11 ' A' ' 38' ' ' LEU . 42.3 mm -72.18 -46.59 57.56 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.594 177.027 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 1.7 mp0 -58.13 -46.02 86.35 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 120.97 0.414 . . . . 0.0 111.016 175.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 50.3 tptt -58.82 -40.28 83.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.821 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -104.22 17.83 23.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.981 -175.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.7 OUTLIER -60.02 -43.38 95.31 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.138 0.494 . . . . 0.0 110.114 -177.868 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -57.58 -40.1 78.23 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.182 176.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.599 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 6.9 mmpt? -71.46 -48.19 50.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.633 0.254 . . . . 0.0 111.272 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.503 HD21 HG21 ' A' ' 94' ' ' ILE . 95.1 mt -61.26 -39.71 91.36 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.103 0.478 . . . . 0.0 110.593 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -68.07 -40.12 82.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.243 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.73 -37.04 77.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.24 176.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -66.35 -43.68 85.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.907 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 pt -75.2 -29.92 22.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 120.713 -0.395 . . . . 0.0 112.037 -174.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -80.93 -27.05 36.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.699 0.285 . . . . 0.0 111.329 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -80.44 -176.96 5.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.928 0.394 . . . . 0.0 110.693 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.1 m -79.09 124.14 28.01 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.165 -176.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -77.67 -27.1 50.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.345 0.593 . . . . 0.0 109.99 171.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -97.97 -167.04 1.46 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.437 178.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -153.53 155.19 35.74 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.049 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.3 m -72.04 -20.08 61.74 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.301 -171.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -63.19 -21.09 65.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.167 177.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 16.3 p -115.45 -54.48 2.53 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.515 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -91.65 -179.16 5.27 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.016 -175.001 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.57 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 0.8 OUTLIER -93.76 24.67 3.99 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.607 -177.59 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -60.56 108.78 0.88 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.333 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -69.6 -15.28 63.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.128 0.489 . . . . 0.0 110.163 178.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -73.54 68.14 1.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.293 0.568 . . . . 0.0 109.865 174.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 40.8 m -85.13 17.32 3.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.802 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -92.1 12.84 20.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.229 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.657 ' HB2' ' HG2' ' A' ' 81' ' ' GLU . 77.0 m-20 -62.23 110.49 1.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 172.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.548 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.2 pt? -56.19 -50.99 69.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.123 -178.354 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.448 HD22 ' HG ' ' A' ' 79' ' ' LEU . 3.9 mm? -88.02 62.15 6.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.509 0.195 . . . . 0.0 111.0 173.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.657 ' HG2' ' HB2' ' A' ' 78' ' ' ASN . 1.6 mm-40 -72.8 159.75 33.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.959 0.409 . . . . 0.0 110.113 177.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 79.95 -8.66 49.68 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.038 -174.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.431 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 35.0 m-85 -122.17 172.57 8.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.1 m80 -129.76 144.41 52.89 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 171.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.06 135.5 19.05 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.428 2.085 . . . . 0.0 112.328 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -136.6 133.58 36.48 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 93.8 mt -71.44 138.38 49.01 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.183 -176.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.439 HG21 ' HG3' ' A' ' 97' ' ' GLU . 30.7 m -134.33 149.92 30.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.821 177.117 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.6 p -103.58 117.91 49.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-O 121.089 0.471 . . . . 0.0 109.983 174.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -117.97 93.92 4.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.765 -177.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 58.62 -87.96 0.02 OUTLIER Glycine 0 CA--C 1.521 0.409 0 CA-C-N 115.463 -0.79 . . . . 0.0 114.461 175.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.832 ' HD3' ' H ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -99.07 -15.19 19.11 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -170.292 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.6 p -148.6 170.73 17.46 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.224 0.535 . . . . 0.0 111.569 -173.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.503 HG21 HD21 ' A' ' 57' ' ' LEU . 59.4 mt -106.78 136.49 41.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.377 -179.675 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -130.06 179.2 6.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.899 0.38 . . . . 0.0 110.732 -173.388 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 57.9 mt -127.22 114.11 35.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.259 -178.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.439 ' HG3' HG21 ' A' ' 88' ' ' VAL . 31.6 mt-10 -114.39 153.19 30.29 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.164 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.431 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 38.2 m-85 -105.68 130.39 53.71 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.123 0.487 . . . . 0.0 111.923 -173.087 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.3 p90 -106.67 149.66 27.03 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 171.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -69.75 139.79 53.35 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.214 -0.594 . . . . 0.0 110.701 -174.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.568 ' SG ' HG12 ' A' ' 103' ' ' VAL . 49.2 t -48.07 123.69 10.38 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.241 177.144 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.96 -14.02 40.82 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.306 2.671 . . . . 0.0 113.887 -172.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.568 HG12 ' SG ' ' A' ' 101' ' ' CYS . 8.4 p -67.81 -25.17 31.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.977 0.418 . . . . 0.0 110.408 178.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.679 -179.819 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 . . . . . 0 N--CA 1.461 0.095 0 CA-C-O 121.024 0.44 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.535 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 81.3 t80 -63.52 -51.79 63.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.839 175.837 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.418 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -71.17 -31.84 68.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -177.514 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -64.14 -48.86 74.38 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.702 177.303 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 17' ' ' PHE . 6.1 ptp180 -64.89 -31.41 72.63 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.8 tp -68.67 -49.37 59.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.254 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.5 -35.81 81.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.937 0.399 . . . . 0.0 110.03 176.136 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -60.98 -55.48 32.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.265 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.411 ' O ' HG23 ' A' ' 28' ' ' VAL . 24.8 ptm -65.27 -38.34 89.99 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.153 -179.182 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.5 tptm -63.56 -41.71 98.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.155 0.503 . . . . 0.0 110.013 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.476 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 15.2 tm-20 -58.34 -47.11 84.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.954 177.692 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -58.63 -55.23 37.77 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.706 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 24' ' ' MET . 96.3 t -62.65 -42.21 95.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.949 0.404 . . . . 0.0 111.167 -174.819 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.5 mmt -77.51 -5.62 50.67 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -174.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HE3' ' O ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -127.24 6.51 6.43 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.306 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.588 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 0.8 OUTLIER -84.23 136.91 33.76 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.343 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -60.09 -49.18 78.67 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.325 -169.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -65.24 -35.79 82.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.153 0.502 . . . . 0.0 110.669 -174.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 99.5 t -62.21 -37.82 79.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.095 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.588 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 70.8 mm-40 -58.73 -44.69 90.54 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.321 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.99 -48.17 82.53 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.107 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -62.23 -41.83 98.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.514 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 38' ' ' LEU . 2.7 mm? -59.8 -42.21 92.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.802 -178.215 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -82.42 -21.79 35.58 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.881 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -62.3 -50.89 69.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.556 0.693 . . . . 0.0 110.067 175.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -112.83 36.03 3.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.586 -177.129 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 43' ' ' GLU . 7.3 pt-20 -52.15 -40.54 61.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.464 -175.665 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.442 ' N ' ' HG3' ' A' ' 42' ' ' GLU . 15.2 tp10 -85.49 -13.17 49.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.078 0.466 . . . . 0.0 111.058 -173.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.3 t -99.07 -38.25 6.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.112 0.482 . . . . 0.0 110.754 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.8 mt -83.13 150.18 4.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.648 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -124.23 165.52 17.48 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 173.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -60.43 -40.06 89.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.073 0.463 . . . . 0.0 111.502 -175.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.466 ' HD3' ' HA ' ' A' ' 48' ' ' LYS . 68.1 mmtt -73.03 -31.85 64.71 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.579 -178.199 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 54.4 ttm -54.41 -43.77 71.78 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.897 0.379 . . . . 0.0 110.193 171.09 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.11 -44.19 94.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.751 178.266 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.528 ' HA ' ' HB2' ' A' ' 54' ' ' LEU . 41.2 mt-10 -70.97 -38.45 72.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.759 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -66.57 -23.98 66.28 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.034 0.445 . . . . 0.0 111.372 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.4 m -120.54 25.68 9.62 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.25 176.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.528 ' HB2' ' HA ' ' A' ' 51' ' ' GLU . 51.4 tp -61.58 -34.28 75.32 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.423 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -67.34 -33.49 75.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.031 176.4 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.439 ' O ' HD11 ' A' ' 96' ' ' ILE . 54.4 mmtt -74.6 -43.77 53.95 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.511 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.84 -37.9 80.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.954 0.407 . . . . 0.0 109.989 175.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -74.98 -39.21 61.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.337 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.452 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 40.8 tt0 -63.25 -32.06 73.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.304 0.573 . . . . 0.0 109.858 176.158 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.487 ' HE1' ' C ' ' A' ' 85' ' ' PRO . 69.0 t80 -63.76 -54.88 28.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.408 178.381 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 21.5 pt -65.51 -28.91 45.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.936 -174.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.452 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 9.4 pt-20 -78.23 -37.03 46.25 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.044 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -86.33 113.49 22.36 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.693 0.282 . . . . 0.0 111.67 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.483 ' HB2' ' HD3' ' A' ' 85' ' ' PRO . 11.5 m 53.55 62.13 2.79 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.597 173.22 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -63.49 -27.13 69.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 122.177 0.989 . . . . 0.0 108.777 173.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.3 p30 -138.52 -157.28 0.76 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.272 -1.331 . . . . 0.0 108.188 173.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.6 p -151.25 153.41 34.82 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 170.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 t -65.1 -29.87 70.77 Favored 'General case' 0 C--N 1.313 -1.014 0 O-C-N 123.782 0.677 . . . . 0.0 110.373 -170.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -55.79 -36.12 67.05 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.978 178.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.2 p -103.72 -6.71 21.26 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.57 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -105.27 168.44 9.07 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -95.05 -13.01 25.56 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -76.0 114.73 14.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.343 178.263 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -87.41 -22.55 24.94 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 175.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -75.84 75.76 2.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.897 178.046 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 38.4 t -163.55 133.91 4.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.766 178.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -116.29 77.78 1.13 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.029 0.442 . . . . 0.0 111.036 -175.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -72.25 136.58 46.37 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.358 172.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 46.9 tp -62.84 -67.45 0.42 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.221 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.476 ' HB3' ' CD2' ' A' ' 83' ' ' TYR . 6.0 mp -88.08 90.71 8.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.742 170.051 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -83.0 144.84 29.68 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.86 -7.8 78.82 Favored Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -169.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.476 ' CD2' ' HB3' ' A' ' 80' ' ' LEU . 46.1 m-85 -126.07 164.05 21.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.578 -0.311 . . . . 0.0 110.334 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -128.51 154.23 79.4 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 169.4 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.564 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 71.8 Cg_endo -80.14 165.79 21.2 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.467 2.111 . . . . 0.0 112.167 177.214 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -152.69 147.22 25.85 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 173.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 60' ' ' TYR . 2.5 mm? -78.52 140.6 38.54 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.447 177.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.9 m -137.81 141.05 39.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.579 173.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.5 p -89.17 129.69 39.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.171 0.51 . . . . 0.0 111.168 -178.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -132.3 96.08 3.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.736 175.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.52 -113.8 4.6 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.753 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.471 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 29.4 mmt180 -111.61 14.09 21.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.113 0.483 . . . . 0.0 110.321 177.486 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 48.3 t -123.98 148.05 47.27 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.276 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 89.4 mt -110.63 125.94 67.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.032 178.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -109.68 174.78 5.71 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.881 -175.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.439 HD11 ' O ' ' A' ' 56' ' ' LYS . 58.0 mt -126.38 105.74 14.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.625 -176.6 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.564 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 17.4 mm-40 -95.93 -173.88 2.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.877 178.56 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -135.61 143.77 45.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.037 0.446 . . . . 0.0 111.098 179.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -129.71 155.95 45.07 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 173.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -71.79 137.47 47.66 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.831 0.348 . . . . 0.0 110.598 -178.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.561 ' SG ' HG12 ' A' ' 103' ' ' VAL . 43.9 t -55.82 122.83 48.96 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.108 178.633 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -71.02 -7.77 22.15 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.956 2.437 . . . . 0.0 113.536 -175.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.561 HG12 ' SG ' ' A' ' 101' ' ' CYS . 3.8 p -69.67 -19.67 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.009 0.433 . . . . 0.0 110.429 178.322 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.003 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.621 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 0.5 OUTLIER . . . . . 0 CA--C 1.518 -0.282 0 CA-C-O 120.444 0.164 . . . . 0.0 110.951 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -59.14 -50.0 75.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.83 0.348 . . . . 0.0 110.063 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -71.07 -29.25 65.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.161 -179.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -63.24 -49.07 75.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.405 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.621 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 20.5 mtm105 -69.03 -40.76 78.44 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 121.456 0.646 . . . . 0.0 109.449 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 34.1 tp -54.54 -49.29 70.64 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.491 -1.231 . . . . 0.0 111.212 177.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -75.45 -28.32 59.25 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.638 177.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.414 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 55.8 tp60 -62.0 -52.64 63.18 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.273 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.611 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.2 ptm -66.3 -36.43 82.94 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.407 177.325 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -55.3 -50.0 70.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.942 0.401 . . . . 0.0 110.487 175.276 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -58.04 -47.04 84.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.503 178.158 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.42 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 25.9 mtpp -59.8 -42.67 93.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.811 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.612 HG12 HG11 ' A' ' 34' ' ' VAL . 84.5 t -67.81 -36.48 75.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.076 -176.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.4 ptp -82.65 -0.92 49.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.179 0.514 . . . . 0.0 110.387 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.5 tptt -91.61 -12.17 35.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.294 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 24.9 t70 -85.48 136.97 33.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.193 -176.545 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.96 -47.03 75.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.652 -177.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -63.52 -45.37 90.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.036 0.446 . . . . 0.0 110.444 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.612 HG11 HG12 ' A' ' 28' ' ' VAL . 49.7 t -56.41 -56.4 13.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.824 -179.046 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.521 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.2 pt20 -66.13 -29.95 70.35 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -176.587 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.62 -40.75 97.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.016 0.436 . . . . 0.0 109.932 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.468 ' CE2' HD11 ' A' ' 45' ' ' ILE . 93.1 t80 -70.23 -36.34 74.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.95 177.487 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.4 mm? -56.84 -49.46 75.37 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.412 178.03 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.521 ' HG2' ' O ' ' A' ' 35' ' ' GLN . 5.2 ptpp? -77.7 -21.33 52.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.237 0.542 . . . . 0.0 110.624 -178.31 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.81 -60.72 2.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.327 174.496 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -102.48 33.85 3.0 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.737 -174.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -61.62 -20.64 63.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.417 178.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -85.89 -16.06 39.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.807 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 41.3 t -109.94 -42.46 5.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.854 0.359 . . . . 0.0 111.591 -173.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.468 HD11 ' CE2' ' A' ' 37' ' ' PHE . 56.3 mt -78.43 144.0 11.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.668 -175.024 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -106.73 165.39 11.34 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.739 175.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -58.04 -45.15 87.45 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.925 0.393 . . . . 0.0 111.023 176.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.595 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 14.1 mmmm -67.01 -37.35 84.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.708 0.766 . . . . 0.0 110.323 -178.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.435 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 19.1 ttt -57.2 -37.61 72.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.296 176.091 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 28.3 mm -63.73 -54.61 29.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.404 178.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.595 ' OE2' ' HE2' ' A' ' 48' ' ' LYS . 2.0 pp20? -63.1 -43.88 97.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.086 0.469 . . . . 0.0 111.414 -178.155 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.56 ' HE2' ' HA ' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -57.3 -31.91 66.12 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.839 178.124 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 73.3 p -108.92 14.26 24.26 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.457 -178.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.8 tp -59.05 -34.45 71.95 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.928 0.394 . . . . 0.0 110.645 -179.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -66.91 -38.25 85.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.754 176.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.485 ' O ' HD11 ' A' ' 96' ' ' ILE . 27.8 mmmt -66.04 -47.97 72.6 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.058 0.456 . . . . 0.0 109.944 176.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.792 ' HG ' HD21 ' A' ' 87' ' ' LEU . 11.0 mp -64.64 -35.88 82.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.308 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -69.34 -43.05 74.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.73 0.3 . . . . 0.0 110.247 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.502 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 9.2 tp10 -58.66 -37.19 75.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.815 0.817 . . . . 0.0 109.801 174.638 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.493 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 87.9 t80 -61.83 -47.85 83.2 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.581 -1.19 . . . . 0.0 111.689 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.548 HD13 ' HA ' ' A' ' 28' ' ' VAL . 29.8 pt -76.36 -30.54 19.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -177.547 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.502 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 10.1 pt-20 -79.85 -20.09 46.82 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.466 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 10.1 pt20 -82.29 175.8 9.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.862 0.363 . . . . 0.0 110.206 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.1 m -68.35 102.88 1.49 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.102 0.477 . . . . 0.0 110.963 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -69.62 -31.15 69.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.282 177.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -93.76 -165.77 1.38 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.049 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -157.58 162.66 38.77 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.042 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.516 ' HA ' ' O ' ' A' ' 71' ' ' SER . 8.0 p -69.32 -18.93 63.87 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 123.48 0.487 . . . . 0.0 111.908 -174.471 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -77.83 4.98 10.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.109 0.48 . . . . 0.0 110.946 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 26.1 p -145.51 -44.51 0.21 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.712 175.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' A' ' 68' ' ' SER . 2.5 m -105.32 125.37 50.91 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.215 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -87.44 11.02 15.66 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.011 0.434 . . . . 0.0 111.232 -177.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.65 115.16 3.42 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.924 177.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -86.52 -5.3 59.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.679 176.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -60.95 -47.58 85.8 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.9 -177.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 19.0 p -101.28 143.73 30.99 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.8 -176.275 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -94.95 104.55 16.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.06 0.457 . . . . 0.0 110.238 176.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -81.33 103.34 11.03 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 174.209 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.6 tp -52.53 -61.95 1.95 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.727 -177.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.612 ' HB3' ' HB2' ' A' ' 83' ' ' TYR . 4.5 mm? -84.89 87.38 7.34 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.141 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.28 128.52 36.52 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.561 0.696 . . . . 0.0 110.785 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.25 -9.66 65.2 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.354 -175.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.612 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . 37.0 m-85 -117.39 168.39 10.4 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 122.473 0.309 . . . . 0.0 110.517 178.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.423 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 3.3 m80 -131.83 148.22 69.05 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.543 172.321 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -76.63 136.73 17.49 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.211 1.94 . . . . 0.0 111.577 176.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.473 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 40.3 ttpt -136.86 135.72 38.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.08 0.467 . . . . 0.0 110.191 177.265 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.792 HD21 ' HG ' ' A' ' 57' ' ' LEU . 1.0 OUTLIER -67.65 130.42 42.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.369 177.945 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.5 m -130.51 148.62 33.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 120.939 0.4 . . . . 0.0 110.88 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.7 p -97.64 115.08 36.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 173.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -117.89 96.17 5.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.447 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 63.56 -100.61 0.38 Allowed Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.481 -0.782 . . . . 0.0 112.827 177.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -112.18 15.16 20.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.144 0.497 . . . . 0.0 111.758 -176.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.1 p -143.85 149.02 36.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.681 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 62.6 mt -98.78 132.66 43.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 174.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -132.9 178.3 6.98 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.051 0.453 . . . . 0.0 110.699 -171.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.485 HD11 ' O ' ' A' ' 56' ' ' LYS . 40.7 mt -119.62 113.96 42.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.329 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -105.23 178.52 4.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.163 176.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.528 ' CE1' ' HB2' ' A' ' 80' ' ' LEU . 16.3 m-85 -127.59 129.16 46.8 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.636 179.131 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.473 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 54.0 p90 -113.17 150.78 31.76 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 174.588 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -65.21 129.96 41.61 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.403 -178.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 36.1 t -45.19 122.5 5.11 Favored Pre-proline 0 N--CA 1.463 0.21 0 O-C-N 123.409 0.443 . . . . 0.0 109.81 173.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.47 -30.09 86.95 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.856 2.371 . . . . 0.0 111.867 -177.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 16.9 t -66.63 -25.35 34.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.355 -178.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt . . . . . 0 N--CA 1.462 0.16 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.465 -174.265 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.74 0.305 . . . . 0.0 110.526 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -64.46 -48.26 75.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.67 178.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -32.8 70.14 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 -178.506 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HE3' ' HB3' ' A' ' 19' ' ' LYS . 9.1 mmmt -57.74 -55.69 31.65 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.771 177.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.435 ' HA ' ' HB2' ' A' ' 23' ' ' GLN . 7.4 ptm85 -69.36 -25.73 64.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.381 -176.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.7 tp -68.74 -50.7 48.5 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.964 0.411 . . . . 0.0 111.0 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -73.05 -30.75 63.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.462 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.435 ' HB2' ' HA ' ' A' ' 20' ' ' ARG . 18.9 mt-30 -60.24 -57.0 14.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.768 178.13 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.443 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.6 ptm -57.51 -43.11 83.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.095 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.8 tptp -63.07 -39.58 95.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.748 0.309 . . . . 0.0 110.808 177.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -61.61 -50.72 71.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.582 178.035 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -56.27 -48.57 76.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.012 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 24' ' ' MET . 89.1 t -60.43 -43.0 93.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.101 0.477 . . . . 0.0 110.569 -179.412 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.6 mtp -86.26 13.92 7.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.143 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -110.66 -34.04 6.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.98 0.419 . . . . 0.0 110.555 177.169 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.69 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 25.2 t70 -59.58 127.22 30.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.282 -174.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -69.59 -25.4 63.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.44 -174.35 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -83.04 -35.96 25.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.409 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.2 t -57.43 -47.13 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.875 0.369 . . . . 0.0 110.46 171.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.69 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 47.8 mt-30 -65.24 -36.65 84.81 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.319 0.581 . . . . 0.0 110.434 179.247 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.55 -39.99 93.09 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.333 175.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.55 ' CD2' HD23 ' A' ' 87' ' ' LEU . 58.0 t80 -66.07 -40.66 91.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.792 176.292 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 38' ' ' LEU . 2.1 mm? -59.79 -42.01 92.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.291 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -80.63 -24.11 39.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.118 0.485 . . . . 0.0 110.655 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.04 -53.24 52.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.556 0.693 . . . . 0.0 110.124 178.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -113.94 31.93 6.21 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.462 -173.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 9.8 pt-20 -62.91 -18.86 63.61 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.573 -178.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -77.71 -27.92 50.78 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.491 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 37.9 t -103.75 -37.18 4.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.55 -173.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.43 HD11 ' CZ ' ' A' ' 37' ' ' PHE . 74.0 mt -80.03 148.43 5.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.681 -174.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -130.06 174.5 9.73 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 174.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 91.8 mt-30 -59.24 -44.55 92.35 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 -175.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -67.17 -36.52 81.95 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.965 0.412 . . . . 0.0 111.149 -175.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 46.7 ttm -58.18 -38.0 75.83 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.842 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.2 mm -68.18 -48.48 73.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.622 176.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -53.47 -48.77 68.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.161 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.619 ' N ' ' HE2' ' A' ' 52' ' ' LYS . 0.8 OUTLIER -65.76 -43.25 89.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 -178.353 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.426 ' O ' HD13 ' A' ' 57' ' ' LEU . 8.3 m -89.95 13.02 15.75 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.189 -173.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.92 -33.9 69.27 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.028 0.442 . . . . 0.0 110.668 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -70.29 -37.44 74.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.585 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.456 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.6 mmmt -69.16 -42.62 75.66 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 120.911 0.386 . . . . 0.0 110.398 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.885 ' HG ' HD21 ' A' ' 87' ' ' LEU . 9.6 mp -61.78 -40.72 96.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.996 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -69.21 -44.37 72.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.104 0.478 . . . . 0.0 110.238 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -54.23 -45.85 72.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.778 174.757 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.457 ' CG ' HD13 ' A' ' 87' ' ' LEU . 32.9 t80 -60.25 -50.81 72.19 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.846 -1.07 . . . . 0.0 112.768 -178.505 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.469 ' O ' ' HE2' ' A' ' 65' ' ' LYS . 29.8 pt -64.82 -30.28 49.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -173.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.425 ' HG2' HG13 ' A' ' 61' ' ' ILE . 6.7 mm-40 -90.01 -29.69 18.26 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.27 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -85.87 133.13 33.98 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.686 -176.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.481 ' HB3' ' HG3' ' A' ' 85' ' ' PRO . 15.2 t 49.7 40.12 19.22 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.287 0.565 . . . . 0.0 112.254 168.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HE2' ' O ' ' A' ' 61' ' ' ILE . 11.8 ptpt -63.85 -24.32 67.7 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.302 0.572 . . . . 0.0 110.203 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 34.1 p30 -130.82 -170.35 2.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.026 171.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.0 p -152.58 164.1 38.31 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 176.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.523 ' HB3' ' OE2' ' A' ' 81' ' ' GLU . 31.0 t -63.48 -37.01 85.65 Favored 'General case' 0 C--N 1.317 -0.805 0 O-C-N 123.294 0.371 . . . . 0.0 110.973 -170.089 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.653 ' CZ ' ' HG3' ' A' ' 104' ' ' LYS . 2.6 t80 -55.56 -21.99 19.77 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.246 0.618 . . . . 0.0 111.935 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.5 p -124.28 11.57 8.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.159 0.504 . . . . 0.0 110.204 -179.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.4 ' HB3' ' HA ' ' A' ' 68' ' ' SER . 31.5 t -104.68 121.25 43.19 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.806 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -84.05 -21.9 31.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.805 178.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.03 137.82 32.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.291 174.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -83.72 -21.23 32.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.116 -176.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -100.27 27.95 5.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.052 0.453 . . . . 0.0 111.082 -172.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 31.7 t -80.65 149.94 29.62 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -102.1 112.04 24.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.862 0.363 . . . . 0.0 111.688 -176.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -176.27 149.15 0.82 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.609 173.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.5 mp -100.32 -41.72 6.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.184 0.516 . . . . 0.0 110.49 -177.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.438 ' HG ' ' CE2' ' A' ' 98' ' ' TYR . 3.1 mm? -72.45 112.01 8.14 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.381 -177.066 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.523 ' OE2' ' HB3' ' A' ' 68' ' ' SER . 4.9 tp10 -95.33 138.74 32.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.148 176.074 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 78.05 -7.66 42.68 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.367 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -125.6 153.75 43.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 117.237 0.519 . . . . 0.0 111.2 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -129.5 157.51 76.18 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 168.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.481 ' HG3' ' HB3' ' A' ' 64' ' ' SER . 73.0 Cg_endo -80.21 148.53 19.07 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.526 2.151 . . . . 0.0 111.213 176.754 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.632 ' HB2' ' CD1' ' A' ' 99' ' ' TYR . 20.7 ttpp -137.8 144.11 41.38 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.081 0.467 . . . . 0.0 109.874 175.332 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.885 HD21 ' HG ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -68.69 128.68 37.53 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.744 176.137 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 15.6 m -128.02 145.57 34.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.067 179.043 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 10.8 p -103.69 115.86 46.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.646 0.736 . . . . 0.0 109.881 174.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -114.71 95.51 5.27 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.274 179.036 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.53 -115.08 6.08 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.876 -176.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -107.05 18.61 21.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.069 0.461 . . . . 0.0 111.02 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.0 m -131.05 143.2 50.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.821 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 77.1 mt -102.18 124.15 55.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -121.62 178.33 4.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -175.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.456 HD11 ' O ' ' A' ' 56' ' ' LYS . 54.2 mt -125.02 112.57 32.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.707 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -126.93 158.21 37.42 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.438 ' CE2' ' HG ' ' A' ' 80' ' ' LEU . 12.9 m-85 -97.24 158.28 15.53 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -166.417 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.632 ' CD1' ' HB2' ' A' ' 86' ' ' LYS . 55.3 p90 -139.6 160.92 38.76 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.356 175.302 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -72.32 129.42 38.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.082 0.468 . . . . 0.0 111.586 -179.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 44.0 t -46.88 122.02 7.13 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.607 172.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.89 -22.26 49.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.648 2.232 . . . . 0.0 112.258 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.8 t -68.06 -15.96 20.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.951 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.653 ' HG3' ' CZ ' ' A' ' 69' ' ' TYR . 28.3 tttm . . . . . 0 N--CA 1.456 -0.161 0 CA-C-O 121.167 0.508 . . . . 0.0 110.263 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.602 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 1.5 m-20 . . . . . 0 CA--C 1.52 -0.175 0 CA-C-O 120.649 0.261 . . . . 0.0 110.669 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -49.5 -57.1 7.67 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.467 -178.653 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.425 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 1.5 pt20 -67.59 -29.65 69.05 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.463 -175.585 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.725 ' HE2' ' HA ' ' A' ' 19' ' ' LYS . 9.5 mmpt? -68.04 -37.72 81.67 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.864 -0.335 . . . . 0.0 111.296 -178.245 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.602 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 54.3 mtt180 -70.34 -40.7 73.96 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.646 0.736 . . . . 0.0 109.051 174.774 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.6 tp -57.11 -49.31 76.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.232 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 11.0 mm-40 -66.14 -30.56 71.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.15 0.5 . . . . 0.0 110.536 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.487 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 22.5 tt0 -70.12 -53.21 18.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.794 -176.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.485 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.8 ptm -67.82 -36.33 80.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.633 178.595 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -58.13 -42.39 85.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.16 0.505 . . . . 0.0 109.841 175.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.448 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 3.7 tp10 -62.58 -49.31 75.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.961 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -54.51 -48.78 71.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.352 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 24' ' ' MET . 92.3 t -61.12 -45.18 99.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.128 -178.458 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.7 ptp -82.64 3.4 29.05 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.417 -176.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 13.9 mptt -106.13 -6.13 18.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.688 0.28 . . . . 0.0 110.957 177.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.691 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 15.2 t70 -85.63 129.48 34.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.676 0.274 . . . . 0.0 110.504 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -65.12 -36.74 85.22 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.466 -174.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.43 -38.95 68.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.979 -176.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.4 t -55.75 -49.97 70.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.518 174.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 57.0 mt-30 -61.67 -41.02 96.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.899 -178.613 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.741 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . . . -57.39 -42.1 81.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.72 176.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.501 ' CG ' ' HB3' ' A' ' 87' ' ' LEU . 54.6 t80 -69.62 -39.91 76.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.321 177.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.44 HD11 HD11 ' A' ' 50' ' ' ILE . 1.7 mm? -57.3 -43.28 83.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.41 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.741 ' HE2' ' HA ' ' A' ' 36' ' ' ALA . 52.6 pttt -83.94 -17.76 39.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 111.121 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.83 -52.99 37.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.102 174.172 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -111.33 33.05 4.9 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.721 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.66 -33.14 63.82 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -175.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -82.09 -23.63 35.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.034 0.445 . . . . 0.0 111.128 -177.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.7 t -91.81 -41.88 13.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.193 0.521 . . . . 0.0 110.593 -175.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 37' ' ' PHE . 74.1 mt -73.13 146.67 10.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.549 -178.521 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -120.72 161.29 21.68 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -60.61 -37.85 82.75 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.919 176.255 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.571 ' O ' ' HG2' ' A' ' 52' ' ' LYS . 13.3 mmmm -63.64 -37.54 87.71 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.172 175.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.547 ' HG2' HG13 ' A' ' 94' ' ' ILE . 46.6 ttm -64.0 -32.38 73.91 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.454 177.641 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.44 HD11 HD11 ' A' ' 38' ' ' LEU . 35.5 mm -62.3 -54.44 34.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.331 -179.511 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 2.0 pt-20 -60.81 -47.1 87.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.842 0.353 . . . . 0.0 111.757 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 48' ' ' LYS . 74.4 mmtt -55.87 -48.08 76.2 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.383 0.611 . . . . 0.0 110.536 178.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.533 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.4 m -94.37 13.61 23.13 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.565 -173.755 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -54.44 -47.85 72.4 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.537 0.684 . . . . 0.0 110.265 178.81 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -56.22 -40.84 74.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.735 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.527 ' O ' HD11 ' A' ' 96' ' ' ILE . 13.6 mmmm -70.18 -44.04 69.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.994 -179.288 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 53' ' ' SER . 75.1 mt -62.74 -38.88 92.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.24 0.543 . . . . 0.0 110.187 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -69.74 -41.43 75.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.249 177.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.06 -37.78 80.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.012 0.434 . . . . 0.0 110.511 176.415 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.47 ' CD1' HD13 ' A' ' 87' ' ' LEU . 89.1 t80 -56.38 -50.51 71.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.105 177.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.2 pt -75.49 -29.71 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.812 -178.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -66.42 -46.75 75.46 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.517 177.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -65.81 -175.16 0.27 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.85 -0.613 . . . . 0.0 112.11 -177.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.796 ' HB3' ' HA ' ' A' ' 78' ' ' ASN . 2.9 p -59.92 102.6 0.16 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.193 179.61 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -68.88 -33.1 73.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.469 0.652 . . . . 0.0 110.349 -178.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -124.94 -156.2 0.71 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 173.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.682 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -148.53 152.1 36.26 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 119.659 -0.816 . . . . 0.0 109.843 174.536 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.654 ' HA ' ' O ' ' A' ' 71' ' ' SER . 0.7 OUTLIER -74.68 -23.34 58.61 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.405 -169.951 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.404 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 13.8 t80 -58.26 -20.65 43.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.153 176.17 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.3 p -118.27 -47.05 2.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.967 0.413 . . . . 0.0 110.862 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.654 ' O ' ' HA ' ' A' ' 68' ' ' SER . 8.6 m -100.85 118.37 36.77 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.722 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -83.44 56.57 3.63 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.755 0.788 . . . . 0.0 110.18 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -85.43 122.58 29.78 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.939 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -75.74 -15.43 60.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.037 -173.379 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -119.15 -2.73 10.68 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -174.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 44.7 t -73.18 114.11 11.0 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.893 0.378 . . . . 0.0 110.433 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -77.31 115.59 17.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.886 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.796 ' HA ' ' HB3' ' A' ' 64' ' ' SER . 10.6 m-80 -111.34 132.46 54.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.401 -176.688 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.405 HD22 ' N ' ' A' ' 79' ' ' LEU . 3.1 mm? -89.6 -79.25 0.34 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.811 -0.632 . . . . 0.0 109.331 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB3' ' HD2' ' A' ' 83' ' ' TYR . 7.2 mp -87.35 88.39 7.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.062 175.138 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -64.27 144.4 57.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.66 -179.086 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.21 -8.1 72.46 Favored Glycine 0 N--CA 1.445 -0.752 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.201 -177.348 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.452 ' HD2' ' HB3' ' A' ' 80' ' ' LEU . 61.2 m-85 -121.58 167.34 13.0 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 178.344 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -131.85 145.69 58.58 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 172.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -79.67 135.29 11.46 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.414 2.076 . . . . 0.0 111.709 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.66 139.68 53.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.309 0.576 . . . . 0.0 109.784 173.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.516 HD21 HD22 ' A' ' 57' ' ' LEU . 1.1 tp -77.39 131.52 38.08 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.054 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.453 ' CG2' ' HB3' ' A' ' 95' ' ' ASP . 30.0 m -136.31 170.0 19.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.3 p -112.92 114.52 47.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.368 0.604 . . . . 0.0 110.27 175.305 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -121.14 107.96 13.22 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.644 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.26 -112.47 3.65 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.396 -178.131 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ARG . . . . . 0.433 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 30.7 mmt180 -117.92 12.01 13.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.167 0.508 . . . . 0.0 109.932 177.474 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 38.1 p -128.36 150.79 49.94 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.078 -177.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.547 HG13 ' HG2' ' A' ' 49' ' ' MET . 77.9 mt -86.38 131.91 33.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 176.502 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.453 ' HB3' ' CG2' ' A' ' 88' ' ' VAL . 13.6 t0 -119.5 169.26 10.2 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.932 -170.1 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.527 HD11 ' O ' ' A' ' 56' ' ' LYS . 60.5 mt -126.86 113.93 35.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.908 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -118.14 159.93 22.43 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 175.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -108.84 129.0 55.39 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.176 0.513 . . . . 0.0 111.527 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 45.8 p90 -108.69 153.84 22.87 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -73.41 135.54 44.21 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.541 -176.431 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.575 ' SG ' HG12 ' A' ' 103' ' ' VAL . 47.7 t -45.3 126.3 5.86 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.802 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.51 -13.65 22.05 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.364 2.709 . . . . 0.0 113.885 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.575 HG12 ' SG ' ' A' ' 101' ' ' CYS . 9.9 p -66.9 -23.08 30.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 121.041 0.448 . . . . 0.0 110.348 178.213 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 9.0 mmmm . . . . . 0 C--N 1.332 -0.178 0 CA-C-O 121.578 0.704 . . . . 0.0 109.85 174.503 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.697 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 0.5 OUTLIER . . . . . 0 C--O 1.227 -0.083 0 CA-C-O 120.428 0.156 . . . . 0.0 110.635 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -55.96 -50.95 69.38 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.332 175.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -30.67 69.08 Favored 'General case' 0 C--O 1.226 -0.179 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -178.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 29.5 mmmt -60.33 -47.74 84.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.354 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.697 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 14.0 mtm-85 -71.06 -53.31 15.15 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.1 -51.11 70.61 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.506 -174.173 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -75.98 -28.28 57.78 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 -176.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 52.3 tt0 -64.45 -55.84 18.2 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.079 176.708 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.604 ' O ' HG23 ' A' ' 28' ' ' VAL . 27.6 ptm -62.0 -40.78 96.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.72 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HA ' HD21 ' A' ' 54' ' ' LEU . 80.8 tttt -62.8 -42.58 99.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.43 -178.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.494 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 14.3 tt0 -62.68 -45.97 90.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.864 0.364 . . . . 0.0 110.106 177.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.0 mtpt -55.46 -45.21 76.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.456 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 24' ' ' MET . 72.1 t -61.77 -42.42 94.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.678 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.8 ptp -84.77 14.61 4.57 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.29 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.494 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 2.4 mptm? -115.25 -14.83 11.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.059 176.092 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.639 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 19.6 t70 -74.16 135.33 42.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.069 0.461 . . . . 0.0 110.662 -177.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -66.72 -36.67 83.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.965 -175.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -75.3 -35.86 61.22 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.017 0.437 . . . . 0.0 110.065 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.1 t -59.66 -41.01 83.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.487 174.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.639 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 74.1 mm-40 -57.15 -49.03 77.2 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.139 0.495 . . . . 0.0 110.04 176.225 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -56.14 -40.54 73.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.476 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.32 -43.54 85.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.809 0.337 . . . . 0.0 110.981 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.526 HD11 HD11 ' A' ' 50' ' ' ILE . 3.5 mm? -63.02 -43.25 99.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.824 -177.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -70.77 -32.62 69.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.188 0.518 . . . . 0.0 110.721 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -74.36 -29.57 61.62 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.333 -177.727 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -118.27 28.54 8.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.184 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -63.34 -16.95 61.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.608 0.718 . . . . 0.0 109.931 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -73.89 -25.84 60.23 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.908 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.9 t -119.96 -33.73 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -170.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.515 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 73.1 mt -71.8 143.83 13.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.358 0.599 . . . . 0.0 112.203 -172.311 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -120.1 166.65 13.12 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.91 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -62.52 -41.64 98.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.333 0.587 . . . . 0.0 109.588 174.451 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -63.89 -37.64 88.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.618 -179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.515 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 54.0 ttm -58.56 -39.44 80.27 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.551 176.398 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.526 HD11 HD11 ' A' ' 38' ' ' LEU . 46.6 mm -67.29 -48.31 78.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.742 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -61.78 -37.77 85.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.288 -178.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.473 ' C ' ' HD3' ' A' ' 52' ' ' LYS . 1.1 tmtp? -71.7 -45.99 60.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.386 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.8 m -92.46 16.55 11.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.452 -173.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -56.52 -40.07 74.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.255 0.55 . . . . 0.0 110.383 178.934 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -62.1 -45.67 92.44 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.462 177.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.467 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.6 mmmt -64.88 -49.57 69.99 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.891 0.377 . . . . 0.0 110.752 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.413 ' CD2' ' HG ' ' A' ' 87' ' ' LEU . 90.0 mt -60.76 -39.12 87.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.886 -178.239 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -69.9 -43.08 72.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.696 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -61.2 -31.74 71.5 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.336 0.589 . . . . 0.0 109.839 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.477 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 34.4 t80 -66.4 -46.23 77.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.189 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' A' ' 28' ' ' VAL . 31.2 pt -75.5 -29.01 20.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -176.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -74.23 -35.62 63.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.533 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 19.4 pt20 -75.4 -175.76 2.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.027 0.441 . . . . 0.0 111.016 -178.398 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.0 t -71.35 93.71 1.16 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.299 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -73.83 -26.98 60.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.29 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -96.09 -172.75 2.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.441 177.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.579 ' HA ' ' ND2' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -141.56 154.21 45.31 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.602 179.573 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 71' ' ' SER . 17.5 m -72.4 -11.06 60.53 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.847 -173.23 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -79.5 -3.56 47.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.093 0.473 . . . . 0.0 110.584 176.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 26.0 p -132.42 -27.55 1.75 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.153 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.513 ' O ' ' HA ' ' A' ' 68' ' ' SER . 19.2 m -114.52 115.8 27.8 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 175.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -76.21 -29.25 57.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -173.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -62.86 131.43 48.76 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.586 0.708 . . . . 0.0 110.98 -169.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -62.99 -22.45 66.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.739 -172.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 -64.77 -22.19 66.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.959 0.409 . . . . 0.0 110.967 -177.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 53.1 m -111.01 25.98 11.19 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.999 -178.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -63.58 143.96 57.4 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.158 0.504 . . . . 0.0 110.641 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.579 ' ND2' ' HA ' ' A' ' 67' ' ' CYS . 0.3 OUTLIER -135.61 139.14 43.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.862 -177.046 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.498 ' HG ' ' N ' ' A' ' 80' ' ' LEU . 2.5 pt? -59.72 -52.26 66.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.216 -179.357 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.517 ' HG ' ' HB2' ' A' ' 83' ' ' TYR . 12.8 tp -86.93 74.74 9.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.304 0.574 . . . . 0.0 109.934 177.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -72.43 146.69 46.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.714 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.56 -8.94 76.64 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.606 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' TYR . . . . . 0.517 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 47.8 m-85 -123.65 164.84 18.27 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.484 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 2.0 m80 -128.33 146.79 61.08 Favored Pre-proline 0 CA--C 1.509 -0.616 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 172.309 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' PRO . . . . . 0.539 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 56.5 Cg_endo -75.55 138.47 21.78 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.114 1.876 . . . . 0.0 111.064 172.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.439 ' HD2' ' HD1' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -142.3 153.07 43.58 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.082 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.418 ' CD1' HG12 ' A' ' 96' ' ' ILE . 2.2 mm? -79.21 147.3 32.66 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.882 0.372 . . . . 0.0 110.517 -177.005 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 25.3 m -131.37 135.63 59.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.633 174.57 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.1 p -90.38 114.62 28.28 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-O 121.098 0.475 . . . . 0.0 110.832 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -119.38 95.74 4.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.494 178.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.74 -123.93 7.73 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.554 -1.018 . . . . 0.0 110.554 -174.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -103.77 10.44 36.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.957 0.408 . . . . 0.0 110.33 173.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 24.8 m -116.11 135.91 53.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 78.1 mt -101.84 133.44 45.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.385 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.421 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 3.6 t70 -118.0 178.6 4.36 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -177.57 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.467 HD11 ' O ' ' A' ' 56' ' ' LYS . 53.3 mt -127.31 113.39 31.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 120.705 0.288 . . . . 0.0 110.944 -176.688 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLU . . . . . 0.539 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 29.8 mm-40 -113.86 -173.89 2.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.01 179.011 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.484 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 10.3 m-85 -128.82 150.11 50.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.016 0.436 . . . . 0.0 111.926 -177.621 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.439 ' HD1' ' HD2' ' A' ' 86' ' ' LYS . 53.3 p90 -136.46 158.13 45.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.088 174.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -71.74 132.59 44.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.376 0.608 . . . . 0.0 111.862 -177.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 33.7 t -57.88 122.6 58.52 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.192 173.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.65 -23.14 70.07 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.419 2.079 . . . . 0.0 112.301 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.8 t -64.93 -19.74 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 121.239 0.542 . . . . 0.0 110.823 178.174 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.641 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.065 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ttt . . . . . 0 N--CA 1.485 1.285 0 CA-C-O 121.302 0.572 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 2' ' ' GLU . 0.2 OUTLIER -119.65 88.15 38.65 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.529 -177.666 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.509 ' O ' ' HG3' ' A' ' 6' ' ' ARG . 25.9 Cg_exo -61.11 111.54 1.12 Allowed 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.589 2.193 . . . . 0.0 112.009 -178.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 58.6 mt -74.07 -36.06 43.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.218 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -101.64 59.07 0.62 Allowed Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.782 177.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 3' ' ' PRO . 61.4 mtt85 -58.5 124.56 20.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.789 0.328 . . . . 0.0 110.924 178.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.0 m -85.11 -7.56 59.03 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.263 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.2 tt -78.12 68.22 4.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -137.94 111.02 7.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.452 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.44 131.39 13.16 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.424 -175.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.29 140.04 20.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.7 p -67.33 -16.6 64.35 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.061 0.458 . . . . 0.0 111.949 -174.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -82.4 92.17 1.57 Allowed Glycine 0 N--CA 1.442 -0.912 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.87 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.446 HH11 ' HD3' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -143.47 79.61 13.75 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 121.866 0.841 . . . . 0.0 111.255 178.028 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.54 ' HG2' ' HB3' ' A' ' 17' ' ' PHE . 62.3 Cg_endo -74.04 177.7 7.85 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.339 2.026 . . . . 0.0 111.138 172.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.639 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 22.0 t70 -60.67 -23.4 64.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.223 0.535 . . . . 0.0 109.984 177.003 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.54 ' HB3' ' HG2' ' A' ' 15' ' ' PRO . 92.0 t80 -52.78 -41.32 64.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.475 175.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -70.36 -29.46 66.14 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -178.297 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.639 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 46.9 mtpt -64.9 -39.8 94.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.943 177.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 23.7 mtp180 -66.17 -48.02 72.09 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 174.023 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.435 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 32.2 tp -54.32 -50.17 67.99 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.138 -1.392 . . . . 0.0 112.488 -177.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -71.98 -28.86 63.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.84 0.353 . . . . 0.0 110.873 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -70.66 -50.3 38.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.878 0.37 . . . . 0.0 110.082 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.499 ' O ' HG23 ' A' ' 28' ' ' VAL . 23.1 ptm -67.23 -36.59 81.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.713 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -54.17 -50.57 66.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.115 176.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -68.45 -46.35 70.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.131 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mmmt -53.16 -44.77 68.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 24' ' ' MET . 93.4 t -63.62 -42.47 96.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.011 0.434 . . . . 0.0 110.076 177.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 64.5 mtt -81.81 17.7 1.45 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.138 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -118.39 -11.71 9.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.066 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.608 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 13.7 t70 -85.44 145.77 27.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.86 0.362 . . . . 0.0 110.449 -177.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 -75.46 -35.47 60.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.668 -173.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -68.97 -40.41 78.89 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.82 -43.93 85.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.834 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.608 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 75.4 mm-40 -56.25 -49.88 72.92 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.242 0.544 . . . . 0.0 110.346 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.45 -49.34 78.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.243 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -63.91 -41.95 97.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.222 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.443 HD11 HD11 ' A' ' 50' ' ' ILE . 1.1 mm? -55.52 -51.42 67.07 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.105 -178.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.456 ' HB3' ' HE2' ' A' ' 39' ' ' LYS . 15.5 ptpt -74.67 -24.39 58.79 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.901 0.381 . . . . 0.0 110.99 -177.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -63.79 -46.2 86.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.307 0.575 . . . . 0.0 110.378 177.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -114.88 26.45 10.15 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.665 -176.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.412 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 10.8 pt-20 -67.89 -18.19 64.72 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.835 0.35 . . . . 0.0 111.501 -176.232 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -73.45 -26.46 60.95 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.287 0.565 . . . . 0.0 109.794 175.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.7 t -99.2 -42.58 10.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.056 -176.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.4 mt -80.15 144.2 11.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.378 -175.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -114.31 163.31 15.46 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.936 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -55.22 -43.15 74.24 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.309 0.576 . . . . 0.0 111.265 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -69.55 -36.31 76.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.287 -178.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 57.8 ttm -56.13 -38.59 71.03 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.529 174.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.443 HD11 HD11 ' A' ' 38' ' ' LEU . 42.6 mm -61.77 -47.25 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.988 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 46.3 mt-10 -70.91 -30.62 67.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.499 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -70.68 -43.59 68.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.671 0.272 . . . . 0.0 110.752 176.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.0 m -92.92 19.61 7.54 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.41 -179.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -51.74 -51.72 54.02 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.13 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -52.94 -45.08 67.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.579 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.487 ' O ' HD11 ' A' ' 96' ' ' ILE . 38.3 mmtm -63.68 -53.69 47.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.211 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.36 -33.58 75.84 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.695 -177.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.401 ' O ' ' HB3' ' A' ' 62' ' ' GLU . 42.9 t80 -73.65 -41.0 63.3 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.871 0.367 . . . . 0.0 110.477 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.449 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 42.1 tt0 -65.88 -33.04 74.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.495 0.664 . . . . 0.0 109.882 177.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -58.71 -51.61 69.24 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.6 177.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.0 pt -75.17 -28.25 20.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.876 -176.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.401 ' HB3' ' O ' ' A' ' 58' ' ' TYR . 0.0 OUTLIER -73.83 -33.06 64.0 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.031 -175.327 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 55.3 mt-30 -81.02 179.48 7.84 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.875 0.369 . . . . 0.0 111.145 -178.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.1 t -66.65 117.06 8.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.692 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -75.23 -27.0 59.35 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.394 0.616 . . . . 0.0 110.175 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -102.55 -160.89 0.81 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.41 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -154.46 157.84 39.03 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 177.196 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.6 t -79.21 -9.83 59.67 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.194 0.521 . . . . 0.0 110.703 -172.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -69.69 -11.56 60.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.211 0.529 . . . . 0.0 110.604 173.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 17.8 p -126.49 -40.33 1.95 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.255 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.2 m -99.0 153.44 18.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.1 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.44 16.12 6.92 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.229 0.538 . . . . 0.0 110.691 178.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -68.16 86.21 0.26 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.833 176.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -80.41 -11.27 59.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.055 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -81.1 -13.42 58.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.615 -175.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 66.9 m -87.96 115.53 25.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.516 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -78.06 108.11 11.1 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.245 177.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -120.12 135.63 54.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.817 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.668 ' HG ' HD22 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -104.29 -35.93 7.8 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.166 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.668 HD22 ' HG ' ' A' ' 79' ' ' LEU . 3.2 mm? -87.12 49.19 1.77 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.976 170.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -67.41 147.5 52.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.33 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 94.0 -9.03 73.14 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.467 -173.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.42 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 56.2 m-85 -125.0 171.81 9.93 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.452 ' HB2' ' CZ ' ' A' ' 99' ' ' TYR . 16.9 m170 -130.5 147.48 66.11 Favored Pre-proline 0 C--N 1.329 -0.291 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 171.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.96 135.49 15.64 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.363 2.042 . . . . 0.0 112.472 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -136.95 146.33 45.27 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 172.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.6 mt -80.72 142.95 33.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.802 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 23.2 m -139.94 141.36 34.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.938 175.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.1 p -93.37 114.68 30.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.498 0.666 . . . . 0.0 110.454 179.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -116.0 96.68 5.69 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.676 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.95 -112.98 4.71 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.665 -177.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.494 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 8.0 mpt_? -106.85 0.9 24.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.909 0.385 . . . . 0.0 110.965 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 12.2 p -121.5 147.58 45.59 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.006 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 55.9 mt -103.66 124.57 58.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.956 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -109.77 177.62 4.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.245 0.545 . . . . 0.0 110.839 -175.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.487 HD11 ' O ' ' A' ' 56' ' ' LYS . 47.4 mt -126.53 105.88 14.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.283 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -105.46 150.75 25.02 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.237 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.42 ' CD2' ' HB2' ' A' ' 83' ' ' TYR . 17.2 m-85 -100.17 126.87 46.49 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.056 179.267 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.452 ' CZ ' ' HB2' ' A' ' 84' ' ' HIS . 54.3 p90 -105.49 144.34 32.39 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 173.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -63.2 138.71 58.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.111 0.481 . . . . 0.0 111.069 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 40.6 t -56.63 123.37 57.0 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.456 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.07 -17.15 58.78 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.815 2.343 . . . . 0.0 112.213 -178.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.9 t -69.63 -15.76 19.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.827 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -67.75 -22.91 65.2 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 17.1 mmm180 -95.45 126.74 40.96 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.429 176.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? . . . . . 0 C--N 1.318 -0.773 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.022 175.776 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.0 tpt . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 120.861 0.363 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -127.65 153.13 77.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.684 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.58 135.11 37.76 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.52 2.147 . . . . 0.0 112.021 176.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.77 HG22 ' H ' ' A' ' 6' ' ' ARG . 4.3 mp -88.46 135.55 25.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -68.08 -12.41 62.78 Favored Glycine 0 CA--C 1.52 0.382 0 C-N-CA 121.143 -0.551 . . . . 0.0 113.25 -176.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.77 ' H ' HG22 ' A' ' 4' ' ' ILE . 16.5 ptp180 -128.67 102.17 6.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.4 0.619 . . . . 0.0 110.2 178.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.1 p -73.38 -18.05 61.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.615 -177.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.435 ' N ' HD12 ' A' ' 8' ' ' LEU . 5.2 mp -74.79 -18.4 60.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.343 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -141.5 -154.64 0.53 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.946 -177.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.05 -65.53 2.57 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.454 175.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 5.2 m -108.42 94.6 3.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.609 0.719 . . . . 0.0 111.244 -178.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 p -98.38 86.27 3.59 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.678 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 149.48 109.91 0.52 Allowed Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.596 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -154.45 87.53 3.48 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-O 120.709 0.29 . . . . 0.0 110.466 -178.974 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.444 ' HD2' ' HA ' ' A' ' 14' ' ' ARG . 4.8 Cg_endo -48.02 144.74 11.62 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 123.184 2.59 . . . . 0.0 112.061 178.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.473 ' HA ' ' HG3' ' A' ' 19' ' ' LYS . 2.9 m-20 -76.63 -3.3 37.07 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -171.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -65.16 -54.89 22.82 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.483 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 27.8 pt20 -66.88 -30.23 70.34 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.41 178.145 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.473 ' HG3' ' HA ' ' A' ' 16' ' ' ASP . 5.9 mmmm -57.98 -48.41 80.06 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 174.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.422 ' O ' ' HG2' ' A' ' 24' ' ' MET . 2.6 tpp180 -66.57 -45.2 80.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.385 177.032 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.483 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 26.8 tp -53.94 -49.42 68.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.319 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -67.02 -40.36 87.24 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.922 177.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 27.3 tt0 -59.29 -51.33 70.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.827 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.426 ' O ' HG23 ' A' ' 28' ' ' VAL . 18.1 ptm -73.55 -37.37 65.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.078 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.496 ' HE2' ' HG2' ' A' ' 51' ' ' GLU . 4.5 tppp? -59.76 -40.51 88.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 110.143 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.68 -50.53 70.78 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.323 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -58.14 -47.0 84.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.524 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.529 ' HA ' HD13 ' A' ' 61' ' ' ILE . 74.8 t -62.66 -42.23 95.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.063 -177.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 24.3 mmt -82.98 15.52 2.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.751 0.31 . . . . 0.0 111.279 -178.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -107.27 -20.38 13.3 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.083 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.689 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 35.1 t70 -77.37 131.36 38.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.937 0.399 . . . . 0.0 111.237 -175.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -59.45 -45.61 91.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.808 -177.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -67.56 -39.43 84.93 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.423 -177.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.8 t -54.83 -49.61 68.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.661 174.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.689 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 36.0 mt-30 -64.38 -40.41 95.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.232 0.539 . . . . 0.0 110.607 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.429 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -59.77 -38.85 82.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.33 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.505 ' CZ ' HG23 ' A' ' 89' ' ' VAL . 59.3 t80 -69.82 -44.26 70.33 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.735 177.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.553 HD11 HD11 ' A' ' 50' ' ' ILE . 1.2 mm? -54.41 -47.91 72.23 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.355 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.6 pttt -76.11 -27.06 56.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.028 0.442 . . . . 0.0 111.114 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 5.3 tp10 -65.57 -42.45 91.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.134 0.492 . . . . 0.0 110.124 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -116.01 27.67 9.11 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.161 -176.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -66.94 -16.1 64.11 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.971 0.415 . . . . 0.0 111.734 -175.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -77.85 -19.41 54.91 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.109 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 40.4 t -113.68 -40.74 3.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.992 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.537 ' CG1' HG21 ' A' ' 89' ' ' VAL . 62.4 mt -72.09 141.92 15.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.499 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -115.48 164.1 14.78 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.461 -0.79 . . . . 0.0 108.87 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -59.92 -40.19 88.01 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -64.88 -38.17 90.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.648 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.6 tpp -58.73 -41.75 87.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.325 177.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.553 HD11 HD11 ' A' ' 38' ' ' LEU . 44.6 mm -61.95 -45.81 97.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.856 178.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.761 ' HA ' HD23 ' A' ' 54' ' ' LEU . 34.2 mt-10 -70.35 -33.85 71.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.126 -178.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -64.07 -41.52 97.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.125 0.488 . . . . 0.0 110.123 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.4 m -107.18 27.46 9.02 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.087 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.761 HD23 ' HA ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -55.29 -46.21 76.21 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 121.151 0.501 . . . . 0.0 110.024 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -63.72 -29.64 70.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.017 -176.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.471 ' O ' HD11 ' A' ' 96' ' ' ILE . 65.0 mmtt -68.19 -53.98 21.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.092 0.473 . . . . 0.0 110.103 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.2 mp -65.63 -36.74 84.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.724 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -65.83 -42.16 90.87 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.18 -0.463 . . . . 0.0 109.898 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -58.07 -48.21 80.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.619 175.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.404 ' HD1' ' HB2' ' A' ' 85' ' ' PRO . 51.5 t80 -56.13 -49.26 74.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.47 -177.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.529 HD13 ' HA ' ' A' ' 28' ' ' VAL . 29.7 pt -75.13 -29.55 21.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -174.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -80.39 -30.69 37.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.661 0.267 . . . . 0.0 111.3 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -77.91 -171.78 2.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.159 0.504 . . . . 0.0 110.926 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 31.6 p -74.38 94.03 2.49 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.463 177.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -64.45 -32.93 74.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.614 0.721 . . . . 0.0 109.399 173.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.477 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.0 t-20 -92.22 -159.93 0.7 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.128 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.486 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -153.95 149.57 27.41 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.447 175.604 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.49 ' HA ' ' O ' ' A' ' 71' ' ' SER . 13.7 t -75.21 0.65 15.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.82 -173.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.446 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 5.3 t80 -82.41 -12.68 57.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.199 176.035 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.477 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 25.6 p -127.53 -40.81 1.75 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.57 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.49 ' O ' ' HA ' ' A' ' 68' ' ' SER . 50.2 p -98.34 149.29 22.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 174.461 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 14.9 tt0 -102.35 -2.93 27.93 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.782 -176.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -58.33 133.25 55.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.469 0.652 . . . . 0.0 110.557 -176.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -94.76 5.44 51.86 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.334 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -68.55 -39.74 80.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.889 -177.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 21.8 p -110.44 114.56 28.09 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.965 0.412 . . . . 0.0 110.181 176.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -74.86 107.47 6.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.676 0.751 . . . . 0.0 109.908 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.707 ' OD1' ' HA ' ' A' ' 81' ' ' GLU . 2.9 t-20 -87.98 103.75 15.98 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.772 -176.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 mp -65.53 -65.53 0.66 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.251 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.2 mp -80.4 77.14 7.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.348 174.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.707 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 29.8 tt0 -73.95 132.54 42.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.598 -175.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.14 -7.53 48.13 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.357 -176.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -122.29 162.91 20.61 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -126.04 147.22 58.49 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 169.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.404 ' HB2' ' HD1' ' A' ' 60' ' ' TYR . 46.2 Cg_endo -71.78 136.79 28.52 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.315 2.01 . . . . 0.0 112.358 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.476 ' HB3' ' CD1' ' A' ' 99' ' ' TYR . 20.6 ptmt -128.11 131.72 49.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.416 179.127 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 76.2 mt -78.92 134.66 36.86 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.177 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.2 m -132.18 139.68 49.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.121 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.537 HG21 ' CG1' ' A' ' 45' ' ' ILE . 78.8 t -88.98 114.67 27.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.405 0.621 . . . . 0.0 109.673 175.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -117.05 95.32 4.94 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.133 -172.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.17 -113.94 6.29 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.062 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.526 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 0.2 OUTLIER -105.7 18.34 22.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.752 0.31 . . . . 0.0 111.386 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.3 m -138.98 167.62 21.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.09 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 76.2 mt -114.68 131.71 66.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -115.62 177.57 4.62 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 -176.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.471 HD11 ' O ' ' A' ' 56' ' ' LYS . 51.0 mt -132.98 108.88 13.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.285 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -99.55 -174.93 2.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.809 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -133.37 124.26 26.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.927 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.476 ' CD1' ' HB3' ' A' ' 86' ' ' LYS . 55.2 p90 -107.22 152.12 24.52 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 100' ' ' GLU . 0.6 OUTLIER -74.14 130.29 39.49 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.417 0.627 . . . . 0.0 110.616 -175.876 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.41 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 48.9 t -46.31 122.88 6.75 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.587 174.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 14.7 Cg_endo -60.51 -9.58 11.45 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.132 2.555 . . . . 0.0 113.099 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 91.8 t -78.44 -25.23 13.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 177.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -65.83 -41.28 91.98 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -135.47 87.95 2.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.126 172.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp . . . . . 0 C--N 1.321 -0.664 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.78 -179.09 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.0 mtp . . . . . 0 N--CA 1.479 0.977 0 CA-C-O 121.052 0.454 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -102.29 148.55 35.59 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.64 -174.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -74.9 158.4 42.61 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.484 2.123 . . . . 0.0 112.018 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.0 tp -73.74 128.33 36.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.177 0.513 . . . . 0.0 110.746 -178.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.443 ' C ' ' HD2' ' A' ' 6' ' ' ARG . . . -88.07 -134.09 4.49 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.293 -179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.621 ' HB3' ' HG ' ' A' ' 8' ' ' LEU . 3.8 mpt_? -124.26 162.54 23.51 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.916 0.388 . . . . 0.0 110.714 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.2 m -77.62 -13.31 59.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.805 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.621 ' HG ' ' HB3' ' A' ' 6' ' ' ARG . 2.8 pp -82.47 9.71 8.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.351 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -55.01 -44.71 74.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.173 -177.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -114.35 36.61 3.9 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.364 -0.922 . . . . 0.0 113.171 -174.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.408 HG22 ' HA ' ' A' ' 8' ' ' LEU . 29.9 m -131.71 164.57 34.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.853 0.326 . . . . 0.0 110.389 177.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.4 t -79.39 39.87 0.41 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.773 0.797 . . . . 0.0 110.662 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -112.42 25.75 11.91 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.091 -179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -149.58 85.73 5.64 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 121.321 0.582 . . . . 0.0 110.713 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -56.52 168.93 1.9 Allowed 'Trans proline' 0 C--O 1.237 0.461 0 C-N-CA 123.881 3.054 . . . . 0.0 113.929 -176.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.93 -23.78 54.96 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.726 -178.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -52.46 -46.97 66.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.2 177.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.423 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -71.43 -30.06 65.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.243 0.544 . . . . 0.0 110.04 -177.909 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -71.13 -42.54 69.08 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.382 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -72.52 -32.26 65.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.751 0.31 . . . . 0.0 110.577 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 tp -65.22 -49.48 69.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.388 177.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.582 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 7.0 mm-40 -73.18 -25.0 60.62 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.923 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -61.96 -56.91 14.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.759 0.314 . . . . 0.0 111.398 174.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.533 ' O ' HG23 ' A' ' 28' ' ' VAL . 23.7 ptm -61.14 -35.56 77.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.956 0.407 . . . . 0.0 109.995 176.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.582 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 4.1 tptm -57.78 -46.18 84.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.923 173.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -53.11 -49.25 66.87 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 123.665 0.786 . . . . 0.0 111.103 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mmmm -59.02 -49.42 77.97 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.783 177.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 24' ' ' MET . 57.6 t -64.18 -41.24 91.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.723 -175.189 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 14.8 ptp -73.73 -4.72 36.23 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -171.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -127.62 -4.08 5.95 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.484 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 0.3 OUTLIER -77.38 126.74 31.39 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.179 0.514 . . . . 0.0 110.239 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -66.68 -33.01 74.7 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.972 -168.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -66.46 -41.23 89.37 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.789 0.328 . . . . 0.0 110.236 177.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 91.3 t -58.28 -44.82 88.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.289 172.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 84.4 mm-40 -55.38 -50.47 69.64 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.922 178.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -54.67 -42.62 71.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.26 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -68.85 -43.44 75.45 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.692 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.712 HD11 HD11 ' A' ' 50' ' ' ILE . 2.4 mm? -61.03 -44.7 97.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.445 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.419 ' HE2' ' HB2' ' A' ' 39' ' ' LYS . 4.1 ptmm? -70.83 -26.05 63.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.045 0.45 . . . . 0.0 110.508 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -73.85 -44.23 56.16 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.974 0.416 . . . . 0.0 110.588 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -112.74 29.02 8.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.505 -176.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -64.22 -22.54 66.98 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.031 0.444 . . . . 0.0 111.354 -176.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -75.11 -25.99 58.91 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.534 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.5 t -101.07 -42.37 9.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.99 -174.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.531 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 65.3 mt -77.87 142.63 13.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.794 -175.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -118.24 165.7 13.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.707 176.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -55.68 -44.33 77.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.901 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.406 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 51.6 mtpt -66.14 -36.89 84.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.086 0.469 . . . . 0.0 110.706 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.531 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 23.0 ttt -60.13 -35.83 76.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.201 177.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.712 HD11 HD11 ' A' ' 38' ' ' LEU . 37.0 mm -64.57 -54.45 30.24 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.839 176.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.516 ' HA ' HD23 ' A' ' 54' ' ' LEU . 7.7 mm-40 -57.53 -42.18 82.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.024 0.44 . . . . 0.0 111.014 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -65.36 -29.73 70.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.082 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.447 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 7.3 m -114.26 20.5 15.49 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.38 -178.136 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.516 HD23 ' HA ' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -58.88 -44.7 91.19 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.922 -177.633 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -60.6 -33.67 73.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.782 178.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.574 ' O ' HD11 ' A' ' 96' ' ' ILE . 32.1 mmmt -73.22 -42.76 62.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 110.91 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.446 HD21 HG21 ' A' ' 94' ' ' ILE . 76.2 mt -65.51 -38.79 90.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.143 0.497 . . . . 0.0 110.132 177.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -70.3 -39.26 74.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.115 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.523 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 38.0 tt0 -57.21 -39.72 76.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.012 175.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -59.51 -52.21 66.55 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.525 177.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.7 pt -74.34 -29.0 23.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -174.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.523 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 7.6 pt-20 -75.63 -20.73 58.31 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.811 178.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 46.3 mt-30 -74.36 -167.15 0.49 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.925 0.393 . . . . 0.0 110.322 174.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.561 ' HB2' ' C ' ' A' ' 77' ' ' ASN . 20.0 t -83.74 130.16 34.95 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.881 0.372 . . . . 0.0 111.212 -177.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -73.05 -26.6 61.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.533 0.682 . . . . 0.0 109.574 173.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.487 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 76.6 m-20 -122.78 -160.09 0.87 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.608 -177.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.435 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 6.8 p -152.63 161.11 43.01 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 176.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.606 ' HB3' ' HG3' ' A' ' 81' ' ' GLU . 48.1 t -60.24 -29.22 68.63 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 123.49 0.494 . . . . 0.0 111.285 -174.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -72.37 -1.92 17.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.032 0.444 . . . . 0.0 111.617 -178.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.9 p -136.31 6.94 3.08 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.591 175.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 38.5 t -145.35 118.65 8.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.865 0.364 . . . . 0.0 110.302 -176.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -81.81 -6.69 59.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.03 177.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -79.73 134.13 36.37 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.019 -174.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -64.28 -26.4 68.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.079 -0.51 . . . . 0.0 112.328 -176.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -81.49 67.45 7.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.824 0.821 . . . . 0.0 110.238 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.451 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 15.7 p -115.51 116.92 29.0 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.454 172.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.561 ' C ' ' HB2' ' A' ' 64' ' ' SER . 56.4 m-20 -79.08 21.81 0.43 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.653 -173.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.454 ' N ' ' HB2' ' A' ' 64' ' ' SER . 3.0 p-10 -103.66 128.06 51.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.153 0.501 . . . . 0.0 111.272 -177.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.868 ' HG ' HD12 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -90.73 -26.89 19.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 168.869 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.868 HD12 ' HG ' ' A' ' 79' ' ' LEU . 5.5 mp -85.51 110.3 19.1 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.258 173.18 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.606 ' HG3' ' HB3' ' A' ' 68' ' ' SER . 33.5 tt0 -88.48 142.05 28.03 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.091 0.472 . . . . 0.0 110.541 -179.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.2 -8.78 77.44 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.887 176.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -126.43 160.3 30.89 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.919 0.359 . . . . 0.0 110.989 -177.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.487 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 13.1 m170 -128.07 149.32 70.67 Favored Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.005 177.157 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.98 153.54 25.33 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.548 2.166 . . . . 0.0 112.166 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -152.6 151.96 31.25 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -82.57 142.65 31.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.964 0.411 . . . . 0.0 110.346 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.493 ' CG2' ' HB3' ' A' ' 95' ' ' ASP . 33.1 m -132.49 155.42 41.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.622 176.008 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.42 HG23 ' CE ' ' A' ' 49' ' ' MET . 4.3 p -99.92 115.15 40.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-O 121.168 0.508 . . . . 0.0 110.08 175.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -120.17 95.82 4.9 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.866 177.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.64 -124.11 28.41 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.088 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -96.59 13.9 26.61 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.83 0.348 . . . . 0.0 111.0 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.5 m -125.24 144.42 50.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.663 -178.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.447 ' HB ' ' CB ' ' A' ' 53' ' ' SER . 60.8 mt -97.56 131.78 43.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 174.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.493 ' HB3' ' CG2' ' A' ' 88' ' ' VAL . 41.3 t0 -126.46 178.08 6.08 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.745 0.307 . . . . 0.0 110.254 -170.229 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.574 HD11 ' O ' ' A' ' 56' ' ' LYS . 77.0 mt -124.39 129.94 73.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-O 121.249 0.547 . . . . 0.0 110.273 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -122.49 172.33 8.44 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.283 177.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -124.42 134.99 52.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.008 0.432 . . . . 0.0 111.268 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -118.21 151.2 38.08 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.588 ' HG2' ' HD3' ' A' ' 104' ' ' LYS . 24.4 tt0 -71.84 137.19 47.36 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.979 0.419 . . . . 0.0 110.582 -175.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.443 ' SG ' HG12 ' A' ' 103' ' ' VAL . 19.8 t -47.58 124.8 9.8 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.505 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.37 -10.91 25.74 Favored 'Trans proline' 0 N--CA 1.474 0.337 0 C-N-CA 123.198 2.599 . . . . 0.0 113.493 -176.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.443 HG12 ' SG ' ' A' ' 101' ' ' CYS . 9.8 p -66.61 -19.39 25.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.282 0.563 . . . . 0.0 110.306 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.588 ' HD3' ' HG2' ' A' ' 100' ' ' GLU . 8.3 mtpm? -80.86 -10.08 59.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.219 -178.053 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 38.2 ttm-85 -136.43 90.44 2.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.853 0.359 . . . . 0.0 110.094 174.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.459 -179.938 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.483 1.179 0 CA-C-O 120.892 0.377 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -116.32 87.34 19.78 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.277 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -70.38 97.59 0.7 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.303 2.002 . . . . 0.0 112.025 -178.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.5 mm -107.69 -43.5 6.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.113 178.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -91.02 144.24 17.1 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.056 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 59.8 mtm180 -103.73 145.83 29.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.669 0.271 . . . . 0.0 110.317 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.4 m -74.9 80.63 2.15 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.311 0.576 . . . . 0.0 111.332 -178.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 33.3 tp -101.53 6.6 42.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.59 0.71 . . . . 0.0 109.848 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -100.42 111.89 24.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.054 -178.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -127.17 41.77 1.56 Allowed Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.14 177.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 13' ' ' GLY . 26.4 t -100.34 148.62 6.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.414 -0.393 . . . . 0.0 110.242 -176.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.3 t -78.02 12.05 1.98 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.45 0.643 . . . . 0.0 110.94 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.435 ' H ' HG12 ' A' ' 11' ' ' VAL . . . -119.36 125.72 6.47 Favored Glycine 0 N--CA 1.447 -0.611 0 N-CA-C 111.19 -0.764 . . . . 0.0 111.19 177.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -142.61 79.65 15.02 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 117.03 0.415 . . . . 0.0 110.853 -176.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -69.85 114.42 3.71 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.613 2.209 . . . . 0.0 111.701 173.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -71.5 -32.46 68.25 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.518 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -52.17 -47.64 65.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.537 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.409 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 1.7 pt20 -68.88 -30.75 69.32 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.208 -175.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 30.3 mmtm -72.13 -38.16 69.32 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -175.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.405 ' HD2' HH11 ' A' ' 20' ' ' ARG . 19.1 ptt85 -75.52 -23.78 56.73 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.444 176.039 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.4 tp -70.48 -48.57 55.12 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.12 174.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 18' ' ' GLN . 37.0 mt-10 -58.92 -43.2 91.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.884 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -58.29 -53.71 55.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.999 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.629 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.3 ptm -68.68 -42.3 78.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.287 -177.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -61.25 -43.06 99.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.719 0.295 . . . . 0.0 110.777 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -64.88 -46.4 81.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.059 0.457 . . . . 0.0 110.173 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -55.75 -45.39 78.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.949 178.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 24' ' ' MET . 74.3 t -62.08 -37.54 78.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.939 0.4 . . . . 0.0 110.79 -179.216 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.8 mtp -82.3 -2.97 54.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.59 -178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -103.8 -6.57 21.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.305 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.413 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 26.1 t70 -77.93 137.61 38.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.824 0.345 . . . . 0.0 110.489 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -67.57 -43.47 80.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.483 -175.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -70.42 -43.67 69.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.53 -177.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.9 t -54.99 -55.18 17.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.855 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 11.0 pt20 -65.61 -34.21 77.7 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -176.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.91 -41.61 86.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.265 0.555 . . . . 0.0 110.192 175.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.507 ' HZ ' HG23 ' A' ' 89' ' ' VAL . 88.4 t80 -61.8 -38.94 89.99 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.812 176.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.82 HD11 HD11 ' A' ' 50' ' ' ILE . 1.6 mm? -61.25 -50.47 72.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.794 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -70.0 -23.1 63.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.025 0.44 . . . . 0.0 111.054 -177.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -76.15 -37.52 57.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.958 176.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -110.71 25.18 12.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.701 -174.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -63.67 -20.78 65.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.076 0.465 . . . . 0.0 111.311 -176.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -75.5 -20.44 58.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.574 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.4 t -108.06 -46.98 7.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.802 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 89' ' ' VAL . 54.6 mt -81.33 144.16 10.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.979 -173.04 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.494 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -130.83 -178.65 4.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.442 176.454 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -64.36 -42.25 96.31 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -60.03 -44.79 94.39 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.589 0.233 . . . . 0.0 110.609 177.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.421 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 38.5 ttm -56.25 -38.95 71.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.537 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.82 HD11 HD11 ' A' ' 38' ' ' LEU . 46.1 mm -60.52 -54.12 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.945 177.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -62.09 -38.11 87.63 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.129 0.49 . . . . 0.0 111.068 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -69.68 -26.46 64.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.608 -178.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 77.3 p -114.37 16.48 17.82 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.265 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.94 -42.68 69.09 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.456 0.646 . . . . 0.0 110.508 178.296 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.519 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 24.4 p-10 -59.67 -44.46 93.59 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.738 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.589 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.1 mmmt -67.48 -49.94 61.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.557 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.6 -41.07 76.39 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.531 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -67.39 -42.77 82.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.072 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 15.9 mm-40 -58.87 -39.36 81.12 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-O 120.9 0.381 . . . . 0.0 110.763 177.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -58.88 -51.33 70.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.531 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.6 pt -71.64 -29.69 35.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.702 -174.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.75 -23.25 55.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.014 0.435 . . . . 0.0 111.093 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 46.9 mt-30 -80.26 167.75 19.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.048 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.2 m -66.9 113.4 4.92 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.52 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -64.83 -26.19 68.23 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.781 172.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -102.19 -163.18 0.98 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.664 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.7 p -159.6 158.04 30.9 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.0 m -67.32 -25.4 66.0 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.067 0.461 . . . . 0.0 110.775 -172.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 104' ' ' LYS . 1.3 t80 -67.76 -5.89 18.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.57 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 28.7 p -135.92 2.63 2.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.749 0.309 . . . . 0.0 111.1 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.8 m -124.33 145.27 49.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.898 0.38 . . . . 0.0 110.16 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -77.26 -13.55 59.92 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.271 0.557 . . . . 0.0 110.844 -175.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.552 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 0.3 OUTLIER -80.13 87.06 5.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.435 179.561 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -68.37 -11.13 59.11 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.583 0.706 . . . . 0.0 110.151 175.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -73.71 -17.58 61.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.218 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.552 ' SG ' ' HB3' ' A' ' 73' ' ' ASP . 59.8 m -71.27 117.4 12.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.892 0.377 . . . . 0.0 111.023 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -87.31 99.83 12.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.996 0.427 . . . . 0.0 110.007 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -102.05 129.75 48.44 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.499 -177.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.596 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.5 pt? -66.9 -24.35 66.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.415 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.485 HD12 ' HG ' ' A' ' 79' ' ' LEU . 5.3 mp -141.96 103.84 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 174.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -94.69 150.49 20.17 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 -176.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.52 -9.41 77.18 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.389 -174.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -124.18 166.99 14.88 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 99' ' ' TYR . 16.7 m170 -127.62 146.84 60.12 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 169.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.3 145.77 39.13 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.063 1.842 . . . . 0.0 111.513 175.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -142.03 149.63 40.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.096 177.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.7 mt -83.59 135.59 34.56 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.058 177.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.478 HG11 ' HG3' ' A' ' 97' ' ' GLU . 29.7 m -133.81 150.63 31.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.616 HG22 HG12 ' A' ' 94' ' ' ILE . 48.4 t -109.84 112.67 41.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.341 0.591 . . . . 0.0 109.499 172.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -108.87 104.07 13.25 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.798 -177.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.74 -105.03 1.42 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.833 -0.699 . . . . 0.0 111.525 -177.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -117.21 5.06 12.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.737 0.303 . . . . 0.0 110.575 178.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.6 p -122.29 138.02 54.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.789 0.328 . . . . 0.0 111.392 -176.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.616 HG12 HG22 ' A' ' 89' ' ' VAL . 66.1 mt -90.53 137.52 21.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.848 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -134.38 178.86 6.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.808 0.337 . . . . 0.0 110.774 -176.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.589 HD11 ' O ' ' A' ' 56' ' ' LYS . 51.8 mt -123.49 110.61 26.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.354 -177.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.478 ' HG3' HG11 ' A' ' 88' ' ' VAL . 7.0 mm-40 -102.83 179.45 4.28 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.24 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -128.25 133.56 48.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.586 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.416 ' CZ ' ' HB2' ' A' ' 84' ' ' HIS . 52.1 p90 -115.91 140.59 49.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.007 174.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -56.82 127.11 30.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.906 178.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.2 t -52.71 122.31 26.4 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.792 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -63.02 -1.12 2.56 Favored 'Trans proline' 0 N--CA 1.476 0.494 0 C-N-CA 123.37 2.713 . . . . 0.0 113.432 -176.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.8 t -79.83 -44.3 23.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.412 175.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.513 ' HB3' ' CE2' ' A' ' 69' ' ' TYR . 14.7 ptmm? -82.3 -21.81 35.96 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.853 0.359 . . . . 0.0 110.874 -178.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 43.6 ttm105 -139.51 99.86 3.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.107 0.48 . . . . 0.0 109.954 174.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.4 tttm . . . . . 0 C--N 1.319 -0.722 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.395 -178.143 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.2 tpt . . . . . 0 N--CA 1.478 0.952 0 CA-C-O 120.931 0.396 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -96.09 156.5 37.01 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.725 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.09 91.4 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.455 2.104 . . . . 0.0 111.432 175.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 68.1 mt -125.4 116.06 45.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.453 -177.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 98.9 137.74 9.96 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.823 177.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 21.2 tpp85 -109.91 107.47 17.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.935 0.398 . . . . 0.0 110.289 176.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.1 t -140.76 141.75 34.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.209 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.505 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.0 tm? -73.36 -27.16 61.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.263 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -83.77 42.1 0.83 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.544 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -77.76 67.69 2.88 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.431 -177.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.78 94.23 4.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 175.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.1 m -73.89 97.1 2.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.769 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 80.95 138.5 2.26 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.74 177.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.447 ' HD3' ' N ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -155.04 78.62 4.77 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 121.449 0.642 . . . . 0.0 110.383 175.839 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.95 155.73 68.6 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.374 2.049 . . . . 0.0 112.16 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.423 ' OD2' ' HD2' ' A' ' 20' ' ' ARG . 16.2 t70 -53.2 -32.37 47.66 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.278 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -53.74 -56.12 20.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.17 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -72.11 -30.64 65.28 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.208 -176.818 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 25.8 mmmt -67.56 -46.5 72.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.475 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.495 ' O ' ' HG2' ' A' ' 24' ' ' MET . 11.4 ptm180 -71.15 -26.59 63.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.0 tp -68.69 -48.82 62.93 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.973 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 11.6 pt-20 -70.77 -30.58 67.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.75 0.309 . . . . 0.0 110.59 175.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 38.6 tt0 -64.73 -53.89 40.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.697 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.495 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 12.0 ptp -61.79 -38.65 88.89 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.464 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 29' ' ' MET . 4.3 tppp? -56.15 -50.26 71.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.323 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.24 -49.93 75.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.635 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -52.01 -51.84 54.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.773 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.456 ' CG1' HG11 ' A' ' 34' ' ' VAL . 84.7 t -62.8 -34.42 65.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.326 -177.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.7 mmt -73.74 -8.93 57.92 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.452 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -102.94 -8.64 20.51 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -176.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -85.28 131.15 34.46 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.391 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.36 -42.06 98.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.152 -178.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -68.99 -45.4 70.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.018 0.437 . . . . 0.0 110.438 -175.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.456 HG11 ' CG1' ' A' ' 28' ' ' VAL . 44.7 t -56.85 -55.41 20.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.534 178.348 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -65.3 -31.64 72.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.799 0.333 . . . . 0.0 111.447 -176.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.2 -42.34 88.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.977 0.418 . . . . 0.0 110.526 174.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -65.75 -37.57 86.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.734 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.3 mm? -57.85 -44.89 86.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.242 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -24.21 40.89 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.77 0.319 . . . . 0.0 110.681 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.88 -49.89 73.07 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.313 0.578 . . . . 0.0 110.343 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -115.62 31.42 6.72 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.273 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.88 -23.41 65.16 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -175.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -85.13 -25.45 27.47 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.222 0.535 . . . . 0.0 110.661 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.4 t -96.12 -40.83 11.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.117 -174.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.7 mt -70.53 140.54 18.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.836 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.425 ' HB2' ' H ' ' A' ' 49' ' ' MET . 16.5 m-20 -91.92 151.02 20.72 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.53 176.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -61.4 -36.28 79.86 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -63.61 -43.06 98.0 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.321 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.425 ' H ' ' HB2' ' A' ' 46' ' ' ASP . 45.2 ttm -55.63 -37.87 68.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.9 178.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.6 mm -63.24 -49.11 84.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.866 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -58.47 -38.04 76.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.264 0.554 . . . . 0.0 110.777 178.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -77.68 -29.96 51.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.476 -176.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 m -106.06 11.68 31.21 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -174.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.8 tp -57.33 -38.1 73.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.867 0.365 . . . . 0.0 110.656 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -60.21 -39.43 86.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.089 177.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -69.9 -43.02 72.59 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.966 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.429 ' O ' HG23 ' A' ' 61' ' ' ILE . 10.8 mp -61.89 -40.63 96.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.351 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.48 ' O ' HG12 ' A' ' 61' ' ' ILE . 13.3 t80 -66.88 -44.17 81.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.993 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.11 -45.33 91.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.383 0.611 . . . . 0.0 110.064 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -58.79 -40.26 83.52 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.595 -178.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.52 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 23.4 pt -75.55 -30.11 21.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.551 -176.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -83.79 -22.76 31.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.785 0.326 . . . . 0.0 111.081 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -105.21 145.01 31.2 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -172.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.593 ' HB3' ' HG3' ' A' ' 85' ' ' PRO . 25.6 t 53.33 34.72 18.53 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 160.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.52 ' HE2' ' HA ' ' A' ' 61' ' ' ILE . 52.8 mmtt -63.02 -26.07 68.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.918 -0.489 . . . . 0.0 111.347 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -131.59 -166.95 1.79 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.042 0.448 . . . . 0.0 110.328 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.8 p -158.13 161.42 37.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.9 p -62.81 -26.68 68.86 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.221 0.534 . . . . 0.0 112.398 -171.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CE2' ' HA ' ' A' ' 104' ' ' LYS . 1.2 t80 -69.0 -16.66 63.78 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.753 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.467 ' HB3' HG21 ' A' ' 103' ' ' VAL . 25.8 p -124.8 5.71 8.1 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.81 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 m -137.16 152.72 50.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 179.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -82.03 -20.03 39.19 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.49 105.39 0.52 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.016 173.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -80.09 -13.39 59.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.223 0.535 . . . . 0.0 110.776 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -87.1 74.61 9.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.471 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 36.2 m -86.47 139.29 31.03 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.672 -176.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -92.26 37.7 0.99 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 171.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -115.26 138.2 51.2 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.176 -172.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.4 mp -80.14 -68.57 0.66 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.423 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.424 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 7.4 mp -85.49 100.83 12.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.876 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -63.68 139.5 58.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.125 0.488 . . . . 0.0 110.698 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.87 -8.69 79.0 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.454 -176.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.409 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 16.3 m-85 -121.96 168.87 11.4 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 122.248 0.219 . . . . 0.0 110.516 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -131.97 153.72 81.48 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.593 ' HG3' ' HB3' ' A' ' 64' ' ' SER . 93.9 Cg_endo -79.0 151.15 23.8 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.638 2.226 . . . . 0.0 112.085 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.408 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 61.9 tttp -147.85 137.36 22.44 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.645 176.35 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.402 HD23 HG12 ' A' ' 96' ' ' ILE . 90.9 mt -68.4 131.76 45.87 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.326 178.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 18.7 m -135.8 149.92 28.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.798 178.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.9 p -104.33 116.75 48.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.386 0.612 . . . . 0.0 110.765 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -112.91 99.0 7.54 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.445 176.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.75 -118.36 6.07 Favored Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.432 -175.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 34.8 mmt180 -111.12 14.17 21.85 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.922 0.392 . . . . 0.0 110.663 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.6 p -122.26 141.9 51.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.677 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 84.1 mt -97.53 130.21 46.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.962 0.411 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -118.12 175.3 5.75 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.427 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.402 HG12 HD23 ' A' ' 87' ' ' LEU . 58.1 mt -128.14 98.06 4.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.787 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -103.91 -175.86 2.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.718 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.424 ' CD2' ' HB2' ' A' ' 80' ' ' LEU . 9.1 m-85 -123.8 138.48 54.5 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -171.328 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.408 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 12.4 p90 -115.06 157.45 23.5 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 170.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -73.69 142.71 46.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.808 0.337 . . . . 0.0 111.613 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.7 t -60.55 122.77 70.27 Favored Pre-proline 0 C--N 1.333 -0.135 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.563 177.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -58.72 -17.03 33.76 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.995 2.463 . . . . 0.0 112.761 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.467 HG21 ' HB3' ' A' ' 70' ' ' CYS . 93.0 t -66.49 -16.85 21.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.953 175.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.462 ' HA ' ' CE2' ' A' ' 69' ' ' TYR . 36.7 ttpt -68.08 -16.84 64.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.313 0.578 . . . . 0.0 109.829 177.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 9.0 tpm_? -94.18 88.82 5.74 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.469 174.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm . . . . . 0 C--N 1.322 -0.587 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.97 179.485 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 tpt . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 121.232 0.539 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.421 ' HA ' ' HD2' ' A' ' 3' ' ' PRO . 3.3 mp0 -116.29 88.3 22.69 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.446 -174.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 2' ' ' GLU . 18.1 Cg_endo -58.73 141.83 98.13 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.714 2.276 . . . . 0.0 112.048 -178.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 62.1 mt -95.15 94.4 4.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -167.9 35.1 0.21 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.972 -177.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -81.57 95.45 7.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.521 0.677 . . . . 0.0 110.058 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 35.8 t -94.42 120.82 35.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.038 -177.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.417 HD22 ' H ' ' A' ' 8' ' ' LEU . 2.9 mm? -68.39 -62.34 1.44 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.219 0.533 . . . . 0.0 110.436 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -140.55 21.34 2.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.562 0.696 . . . . 0.0 109.628 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.15 -159.07 13.95 Favored Glycine 0 N--CA 1.441 -1.019 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 -170.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.6 m -95.32 100.48 11.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 121.648 0.737 . . . . 0.0 110.768 178.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.5 m -68.21 -20.26 64.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.178 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 148.87 174.6 20.63 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.724 177.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.417 ' HA ' ' HD2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -146.29 85.52 7.37 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.393 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.635 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 10.4 Cg_endo -53.45 139.75 64.89 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.315 2.677 . . . . 0.0 112.068 179.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.606 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 1.2 m-20 -63.8 -17.97 63.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.536 -178.332 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -59.83 -52.8 63.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 173.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.635 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -71.13 -33.24 69.91 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.339 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.606 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 45.1 mtpt -58.71 -44.23 90.31 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.218 176.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.448 ' O ' ' HG2' ' A' ' 24' ' ' MET . 18.0 tpp85 -69.45 -51.36 36.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.704 177.095 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.7 tp -58.07 -49.86 75.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.467 -175.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -76.94 -27.3 54.78 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 52.5 tt0 -63.12 -55.57 24.21 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 120.923 0.392 . . . . 0.0 110.077 175.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.632 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.9 ptm -61.84 -34.02 75.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.158 177.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.427 ' HE3' ' HB2' ' A' ' 25' ' ' LYS . 3.7 tppp? -55.29 -55.62 29.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.101 174.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.564 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 39.4 tt0 -62.68 -40.39 96.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.651 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.459 ' HE2' ' HB3' ' A' ' 27' ' ' LYS . 5.2 mmmm -52.39 -39.82 61.32 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.467 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.724 HG12 HG11 ' A' ' 34' ' ' VAL . 68.0 t -70.27 -39.01 76.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.11 -178.394 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 65.7 mtt -73.9 -4.81 37.32 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.532 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 27.3 mmtp -98.81 -5.82 30.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.738 0.304 . . . . 0.0 111.506 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -84.81 141.34 30.55 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.111 0.481 . . . . 0.0 111.201 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -69.94 -39.93 75.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.899 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -77.49 -42.15 36.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.902 0.382 . . . . 0.0 109.997 -174.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.724 HG11 HG12 ' A' ' 28' ' ' VAL . 40.0 t -54.57 -55.49 14.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.214 177.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -65.44 -32.56 74.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.755 0.312 . . . . 0.0 111.217 -177.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.69 -40.12 92.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.003 174.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -65.77 -40.45 92.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.608 176.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.82 HD11 HD11 ' A' ' 50' ' ' ILE . 2.0 mm? -57.54 -45.61 84.89 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.468 178.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -79.77 -20.46 46.22 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.926 0.394 . . . . 0.0 110.804 -178.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -68.4 -52.33 34.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.551 0.691 . . . . 0.0 109.966 176.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -106.86 29.97 6.55 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.329 -177.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -64.68 -16.08 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.283 0.563 . . . . 0.0 110.676 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.12 -19.89 59.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.579 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 39.8 t -119.37 -37.37 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.542 -173.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.8 mt -73.52 140.14 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.322 0.582 . . . . 0.0 111.919 -174.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.79 165.28 11.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.21 176.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -67.89 -36.99 81.2 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 172.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -57.69 -43.66 85.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.227 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 46.6 ttm -59.78 -37.17 78.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.851 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.82 HD11 HD11 ' A' ' 38' ' ' LEU . 38.6 mm -63.25 -54.89 27.25 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.174 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.8 mm-40 -50.83 -46.93 60.2 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 122.978 0.511 . . . . 0.0 111.459 176.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -68.74 -38.94 80.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.991 -177.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.418 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 5.6 m -101.67 17.38 23.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.342 0.592 . . . . 0.0 110.337 -176.103 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.479 HD23 HG22 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -65.36 -43.81 89.64 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.343 -174.658 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -57.54 -34.48 69.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.715 175.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.425 ' O ' HD11 ' A' ' 96' ' ' ILE . 66.5 mmtt -67.27 -53.65 28.01 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.903 0.382 . . . . 0.0 110.807 178.096 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.424 HD11 HG21 ' A' ' 94' ' ' ILE . 10.9 mp -62.72 -39.68 94.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.465 -177.167 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.429 ' O ' ' HG2' ' A' ' 62' ' ' GLU . 48.2 t80 -67.5 -41.24 84.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.986 0.422 . . . . 0.0 110.383 178.171 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 23.5 tt0 -62.54 -41.18 98.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.978 178.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -56.03 -52.81 62.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.832 178.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.6 pt -69.39 -29.86 43.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -174.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 58' ' ' TYR . 60.9 mm-40 -79.17 -17.04 55.69 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.923 0.392 . . . . 0.0 110.927 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 88.5 mt-30 -82.42 -175.3 5.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.423 0.63 . . . . 0.0 111.904 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.1 p -74.42 114.7 13.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.016 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -73.78 -27.53 61.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.912 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.482 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.0 t-20 -115.24 -170.64 1.8 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.03 -170.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.453 ' SG ' ' HB3' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -134.23 143.69 47.97 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.735 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 11.9 t -71.93 -11.5 60.82 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.256 -169.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.453 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 34.4 t80 -63.51 -31.75 73.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.917 175.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.482 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 32.1 p -114.64 -20.17 10.8 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.582 -0.447 . . . . 0.0 112.072 -173.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.5 p -113.42 142.85 45.4 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -112.51 24.55 12.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.525 0.678 . . . . 0.0 110.028 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.14 139.81 46.65 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.963 175.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -62.59 -24.03 67.34 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.937 -178.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -102.31 -1.39 31.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.669 -174.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 17.5 p -93.26 19.8 7.74 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.68 -174.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -71.84 96.35 1.64 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.425 0.631 . . . . 0.0 110.189 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -87.14 141.95 28.27 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.335 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.479 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.3 pt? -61.59 -40.56 95.21 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.055 0.455 . . . . 0.0 110.031 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 24.3 mt -86.32 158.36 19.68 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 172.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -140.48 131.16 25.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.483 0.658 . . . . 0.0 110.742 -170.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 80.69 6.08 89.58 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.893 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.436 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 77.2 m-85 -132.51 156.45 46.77 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 122.261 0.224 . . . . 0.0 110.533 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -126.95 150.6 72.29 Favored Pre-proline 0 N--CA 1.466 0.347 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 175.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.55 149.89 27.54 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 122.552 2.168 . . . . 0.0 112.408 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.1 pttt -147.34 160.1 42.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.118 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -87.2 138.54 31.4 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.538 HG11 ' OE1' ' A' ' 97' ' ' GLU . 18.1 m -133.5 150.39 32.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.554 178.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 p -102.46 120.7 52.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.47 0.652 . . . . 0.0 110.789 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -122.54 99.94 6.67 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.732 176.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.405 ' C ' ' HD2' ' A' ' 92' ' ' ARG . . . 67.66 -111.64 4.21 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.548 -176.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.429 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.3 mpt_? -114.4 15.82 17.89 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.187 0.518 . . . . 0.0 109.884 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.1 p -125.89 138.65 53.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.762 -178.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.424 HG21 HD11 ' A' ' 57' ' ' LEU . 67.4 mt -98.3 132.88 42.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 178.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -124.89 178.92 5.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -176.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.425 HD11 ' O ' ' A' ' 56' ' ' LYS . 50.2 mt -124.51 108.78 21.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.866 0.365 . . . . 0.0 110.59 -176.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.538 ' OE1' HG11 ' A' ' 88' ' ' VAL . 51.5 mt-10 -106.87 -178.14 3.56 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.134 177.121 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.436 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 4.5 m-85 -123.72 132.84 53.91 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.739 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -110.01 154.5 23.09 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -72.77 136.95 45.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.29 0.566 . . . . 0.0 110.848 -175.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 49.2 t -59.29 126.1 80.92 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.051 178.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 9.4 Cg_endo -55.7 -24.0 43.75 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.795 2.33 . . . . 0.0 111.984 176.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.734 ' HA ' ' HG2' ' A' ' 106' ' ' LYS . 25.0 t -81.44 -14.27 12.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.176 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -68.59 -15.68 63.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.535 -173.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 65.1 mtt180 -133.2 33.52 3.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.734 ' HG2' ' HA ' ' A' ' 103' ' ' VAL . 33.8 mmtp . . . . . 0 C--O 1.235 0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.4 175.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.483 1.199 0 CA-C-O 120.942 0.401 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.448 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.6 OUTLIER -108.59 145.51 31.75 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.237 -179.526 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 2' ' ' GLU . 5.5 Cg_exo -78.93 87.57 1.54 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.871 2.381 . . . . 0.0 112.487 -178.1 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 68.7 mt -74.16 -44.06 50.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.221 0.534 . . . . 0.0 110.458 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 113.35 125.17 4.27 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.348 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.76 -9.72 11.21 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.167 0.508 . . . . 0.0 110.409 178.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -129.16 88.94 2.78 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.935 177.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.5 mp -90.4 -60.52 1.9 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.069 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -149.27 132.9 16.8 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.931 178.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -101.12 107.54 3.27 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.536 177.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.6 m -78.62 133.74 29.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.198 0.523 . . . . 0.0 111.311 -177.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.0 p -94.23 2.24 55.92 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.814 175.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.448 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . 130.23 -154.02 20.39 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.088 -178.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.448 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 1.7 mpp_? -142.41 80.12 14.96 Favored Pre-proline 0 C--N 1.324 -0.514 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.47 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 26.7 Cg_endo -63.86 107.37 0.75 Allowed 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.861 2.374 . . . . 0.0 112.089 176.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -69.46 -23.83 63.71 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.162 -176.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -65.58 -48.42 72.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.693 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.47 ' HG2' ' HG2' ' A' ' 15' ' ' PRO . 3.9 pp0? -69.42 -31.67 70.16 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -179.161 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 52.1 mtpt -60.43 -50.11 74.88 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.987 175.027 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -63.95 -45.96 86.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.247 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.7 tp -58.06 -50.14 74.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.664 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 43.5 mm-40 -75.71 -26.97 58.02 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.4 tp-100 -57.98 -57.06 14.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.108 0.48 . . . . 0.0 109.713 174.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.505 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.8 ptm -65.65 -36.08 82.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.522 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 4.9 tppp? -54.01 -52.54 60.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.564 175.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.461 ' HA ' ' HG2' ' A' ' 29' ' ' MET . 38.2 tt0 -66.8 -43.56 83.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.866 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.3 mtpt -56.09 -41.86 75.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.639 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 24' ' ' MET . 73.7 t -64.44 -44.07 97.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.693 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.461 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 23.6 ptp -82.03 2.1 32.6 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.195 0.521 . . . . 0.0 110.765 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 13.9 tptt -94.74 -29.24 14.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.048 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -66.27 143.95 56.9 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.398 0.618 . . . . 0.0 111.538 -174.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -69.11 -47.14 65.93 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.444 -175.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -71.45 -42.8 67.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.798 -177.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.494 HG22 HD11 ' A' ' 87' ' ' LEU . 51.0 t -56.48 -54.6 26.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.758 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -65.92 -30.71 71.33 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.383 -176.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.545 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . . . -62.52 -44.31 96.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.127 174.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.443 ' CE2' HD11 ' A' ' 45' ' ' ILE . 60.1 t80 -64.13 -39.62 94.42 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.676 177.045 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.603 HD11 HD11 ' A' ' 50' ' ' ILE . 2.6 mm? -58.37 -51.78 68.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.636 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.545 ' HE3' ' HA ' ' A' ' 36' ' ' ALA . 23.4 pttp -67.42 -28.16 67.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.023 0.439 . . . . 0.0 110.764 -177.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.81 -28.29 62.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.735 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -122.92 26.81 7.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.707 -174.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -66.52 -15.99 63.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.204 0.526 . . . . 0.0 110.968 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -70.9 -34.83 71.94 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.187 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 19.2 t -102.63 -39.56 6.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.366 -172.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.443 HD11 ' CE2' ' A' ' 37' ' ' PHE . 63.9 mt -75.96 138.46 20.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.069 -175.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.466 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -131.44 -177.72 4.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.905 -178.311 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -57.93 -41.47 82.8 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.758 0.313 . . . . 0.0 111.487 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -71.05 -42.04 69.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.58 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 45.9 tpp -56.26 -36.2 68.3 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.778 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.603 HD11 HD11 ' A' ' 38' ' ' LEU . 41.4 mm -63.94 -49.27 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.896 177.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -68.65 -37.85 79.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.853 -178.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -58.94 -48.47 81.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.158 0.504 . . . . 0.0 110.863 176.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.644 ' OG ' ' HB ' ' A' ' 94' ' ' ILE . 33.6 t -98.8 17.03 20.41 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.769 -173.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 41.4 tp -60.16 -38.15 82.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.794 0.33 . . . . 0.0 110.457 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -74.17 -35.7 64.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.204 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -66.63 -47.01 73.93 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.856 0.36 . . . . 0.0 110.811 177.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 53' ' ' SER . 95.1 mt -66.2 -39.07 89.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.632 -178.155 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -71.61 -37.89 70.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.241 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.675 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 31.2 tt0 -64.29 -36.81 85.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.186 0.517 . . . . 0.0 109.806 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.524 ' CE1' ' HB2' ' A' ' 85' ' ' PRO . 79.8 t80 -56.46 -51.15 69.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.184 176.305 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -74.9 -29.7 22.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -174.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.675 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 7.5 pt-20 -80.14 -13.07 59.55 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.167 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.532 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 45.6 mt-30 -85.63 -177.58 6.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.022 0.439 . . . . 0.0 110.54 174.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.1 t -87.47 105.15 17.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.311 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -69.4 -26.34 64.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.418 . . . . 0.0 109.991 175.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -83.0 -178.27 7.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.881 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 p -147.41 154.7 41.18 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.509 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 3.0 p -55.24 -33.48 63.16 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 124.239 0.962 . . . . 0.0 112.334 -174.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -62.54 -9.89 10.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.722 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.2 p -140.17 -0.79 1.61 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.466 ' OG ' ' HA ' ' A' ' 68' ' ' SER . 27.0 p -105.79 107.23 18.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.385 0.612 . . . . 0.0 111.307 -176.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -86.28 67.87 10.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.745 1.26 . . . . 0.0 109.255 176.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -153.79 156.97 38.69 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 113.006 -1.906 . . . . 0.0 108.435 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.64 -20.36 65.62 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 123.432 0.458 . . . . 0.0 111.563 -178.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -69.65 80.6 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.66 0.743 . . . . 0.0 111.2 177.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.509 ' SG ' ' HB3' ' A' ' 68' ' ' SER . 48.3 t -108.11 23.54 14.34 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.073 176.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -83.44 25.02 0.78 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.982 -174.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -80.14 139.35 36.86 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 174.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.431 ' HB3' HD12 ' A' ' 80' ' ' LEU . 3.0 tt -69.72 -65.19 0.75 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.961 0.41 . . . . 0.0 110.091 -177.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 79' ' ' LEU . 6.6 mp -85.64 122.14 29.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.94 0.4 . . . . 0.0 109.96 177.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -94.82 139.66 30.98 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.091 0.472 . . . . 0.0 110.196 178.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.35 -7.71 81.42 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.733 -178.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -121.27 164.2 17.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.456 0.169 . . . . 0.0 110.627 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.455 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 16.0 m170 -128.51 145.12 54.69 Favored Pre-proline 0 CA--C 1.515 -0.4 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.853 173.623 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.524 ' HB2' ' CE1' ' A' ' 60' ' ' TYR . 20.4 Cg_exo -64.0 135.55 48.23 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.516 2.144 . . . . 0.0 111.823 174.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.631 ' HG3' ' HB3' ' A' ' 97' ' ' GLU . 17.3 ptmt -134.21 146.74 50.4 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.175 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.494 HD11 HG22 ' A' ' 34' ' ' VAL . 98.1 mt -86.92 135.4 33.32 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 120.791 0.329 . . . . 0.0 110.705 -179.177 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 15.5 m -134.35 139.77 47.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.409 177.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.5 p -77.95 122.44 32.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 173.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -123.14 95.45 4.61 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.959 -171.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.449 ' C ' ' HD2' ' A' ' 92' ' ' ARG . . . 61.6 -106.97 1.31 Allowed Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.466 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.518 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 2.4 mpt_? -111.86 19.63 17.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.03 0.443 . . . . 0.0 110.958 -178.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 13.3 t -145.41 178.68 7.93 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.644 ' HB ' ' OG ' ' A' ' 53' ' ' SER . 75.5 mt -116.33 137.33 50.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 174.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -130.51 177.07 7.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.156 0.503 . . . . 0.0 110.953 -173.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 61.7 mt -118.8 122.62 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.852 -176.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.631 ' HB3' ' HG3' ' A' ' 86' ' ' LYS . 14.4 tt0 -107.74 -176.76 3.15 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.425 178.54 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.455 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 9.6 m-85 -137.45 134.76 36.19 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 110.529 -0.174 . . . . 0.0 110.529 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.45 ' CD2' ' HB3' ' A' ' 86' ' ' LYS . 53.4 p90 -117.61 160.83 20.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.215 176.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -72.55 126.03 28.87 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.379 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.428 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 43.4 t -51.01 123.04 18.36 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.523 174.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 9.2 Cg_endo -56.96 -18.7 29.12 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.306 2.671 . . . . 0.0 113.15 178.735 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.3 t -74.83 -13.01 15.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.148 0.499 . . . . 0.0 110.769 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 105' ' ' ARG . 53.3 mmtt -56.89 -51.21 69.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.819 173.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.476 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 12.8 ptm180 45.86 28.72 0.62 Allowed 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.427 1.079 . . . . 0.0 112.814 177.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 104' ' ' LYS . 56.1 mttp . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.221 -178.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.9 ptm . . . . . 0 N--CA 1.483 1.189 0 CA-C-O 120.766 0.317 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -112.86 87.49 10.26 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.94 -176.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -67.38 116.23 4.1 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 122.032 1.821 . . . . 0.0 111.52 177.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.426 ' O ' ' HD3' ' A' ' 6' ' ' ARG . 45.1 mm -67.81 -36.25 75.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.325 0.583 . . . . 0.0 110.123 -178.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.93 -65.01 4.19 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.434 175.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.62 ' HD3' ' H ' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -88.91 79.29 7.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.803 0.811 . . . . 0.0 111.123 -177.001 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.7 m -76.12 92.89 3.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.581 174.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.4 mt -79.64 79.96 6.08 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.803 -174.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -77.11 91.16 3.67 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 165.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.47 84.5 1.81 Allowed Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -168.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.3 m -78.93 0.68 2.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -171.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.0 p -73.84 -10.77 60.0 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.794 -178.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.474 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -137.46 148.44 19.82 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.279 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.474 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.3 OUTLIER -143.26 83.01 11.3 Favored Pre-proline 0 C--N 1.329 -0.289 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.296 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.556 ' HB2' ' HG2' ' A' ' 18' ' ' GLN . 23.6 Cg_endo -62.73 91.39 0.13 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.953 2.436 . . . . 0.0 112.919 177.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.533 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 30.9 t70 -77.27 -28.18 53.37 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.051 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.13 -49.83 72.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.909 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.556 ' HG2' ' HB2' ' A' ' 15' ' ' PRO . 1.5 pp0? -67.92 -30.42 69.74 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 121.166 -0.214 . . . . 0.0 110.587 -178.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.533 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 48.8 mtmt -63.51 -50.11 70.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.96 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 20' ' ' ARG . 11.5 ptm180 -72.54 -28.05 62.6 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.769 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 35.3 tp -67.62 -49.98 60.34 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.858 0.361 . . . . 0.0 110.802 178.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -64.93 -32.66 74.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.419 176.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -62.33 -57.38 11.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.409 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.45 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.7 ptm -63.51 -39.04 93.38 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.792 -179.439 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.58 ' O ' ' HG2' ' A' ' 29' ' ' MET . 19.3 tptp -60.22 -48.85 79.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.457 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.405 ' O ' ' HB3' ' A' ' 30' ' ' LYS . 5.7 tp10 -54.08 -50.35 66.99 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.316 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.62 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 62.8 mtpt -54.86 -48.35 73.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.615 -176.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.563 ' HA ' HD13 ' A' ' 61' ' ' ILE . 91.3 t -64.63 -46.18 93.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.078 0.466 . . . . 0.0 111.112 -176.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.58 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.2 ptt? -88.08 5.99 38.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.442 0.639 . . . . 0.0 110.463 -171.55 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.653 ' HD2' ' N ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -102.81 -34.71 8.9 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.087 -0.961 . . . . 0.0 109.875 175.159 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.653 ' N ' ' HD2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -59.42 132.02 52.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.314 -172.523 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -62.9 -41.93 99.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.939 -172.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -60.1 -39.08 84.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.421 0.629 . . . . 0.0 110.207 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 97.5 t -65.27 -37.93 81.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.663 -179.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 70.9 mm-40 -58.76 -54.09 51.05 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.183 0.516 . . . . 0.0 110.766 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.24 -35.11 76.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.24 -176.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.506 ' CZ ' HG23 ' A' ' 89' ' ' VAL . 82.0 t80 -71.35 -42.4 68.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.714 178.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.757 HD11 HD11 ' A' ' 50' ' ' ILE . 1.1 mm? -59.31 -43.35 92.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.585 -179.053 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -79.14 -25.33 42.9 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.607 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -65.41 -54.75 24.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.304 0.573 . . . . 0.0 110.402 177.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -103.01 30.0 5.1 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.359 -174.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -60.46 -32.47 71.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -175.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -69.88 -28.99 66.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.238 0.542 . . . . 0.0 110.478 -177.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.2 t -97.54 -43.86 12.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.605 -176.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.729 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 66.2 mt -72.36 142.56 15.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.534 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -120.5 164.35 16.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.853 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -54.56 -45.0 73.4 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.305 0.574 . . . . 0.0 110.558 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -66.99 -35.83 80.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.616 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.729 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 23.0 ttt -59.91 -36.59 77.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.402 177.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.757 HD11 HD11 ' A' ' 38' ' ' LEU . 44.0 mm -62.74 -50.94 77.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.537 177.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.84 -39.31 93.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.634 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -60.95 -42.81 98.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.175 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.448 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.7 m -107.62 22.98 15.16 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.976 -175.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 25.6 tp -64.9 -26.33 68.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.01 0.433 . . . . 0.0 109.872 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -67.86 -41.23 83.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.166 176.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -67.71 -50.59 56.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.257 176.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 53' ' ' SER . 83.1 mt -58.19 -40.19 80.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.022 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -71.9 -45.88 59.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.29 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.553 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 40.7 tt0 -62.4 -34.79 77.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.369 0.604 . . . . 0.0 110.163 178.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -56.99 -53.27 59.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.295 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.563 HD13 ' HA ' ' A' ' 28' ' ' VAL . 41.9 pt -73.81 -30.6 28.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -174.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.553 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 8.7 pt-20 -78.74 -19.75 51.58 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 120.939 -0.305 . . . . 0.0 111.53 -177.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -73.2 -177.93 2.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.118 0.485 . . . . 0.0 110.964 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.583 ' HB2' ' HB2' ' A' ' 77' ' ' ASN . 13.7 t -71.42 114.17 9.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.217 -177.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -64.59 -44.66 89.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.004 -179.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.425 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 2.3 m-20 -98.47 -163.45 1.04 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.916 177.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.4 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 4.9 p -148.58 157.09 43.22 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.449 ' OG ' ' HB3' ' A' ' 76' ' ' CYS . 2.6 m -62.23 -24.04 67.01 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.324 0.583 . . . . 0.0 111.188 -171.259 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -62.43 -20.06 64.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.255 177.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.3 p -128.07 -25.54 3.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -176.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.1 p -106.12 -171.91 1.99 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.732 0.301 . . . . 0.0 111.47 -175.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -107.63 17.36 22.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.432 -175.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -69.02 121.46 16.71 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.39 -40.15 27.04 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.043 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -101.97 85.18 2.64 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.102 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.449 ' HB3' ' OG ' ' A' ' 68' ' ' SER . 19.0 p -47.93 114.35 0.9 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.588 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASN . . . . . 0.583 ' HB2' ' HB2' ' A' ' 64' ' ' SER . 75.2 m-20 -87.35 -6.79 58.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.936 175.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.4 ' OD1' ' HA ' ' A' ' 67' ' ' CYS . 12.9 m120 -82.06 116.55 21.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.604 176.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.5 tp -61.09 -55.19 35.5 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.5 mp -86.93 87.72 7.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.566 172.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -72.06 148.97 45.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.023 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.54 -9.06 75.07 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 -171.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.437 ' CB ' ' HD2' ' A' ' 98' ' ' TYR . 74.9 m-85 -123.13 168.05 12.89 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.425 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 17.5 m170 -127.95 150.97 75.02 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 172.062 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.401 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 57.4 Cg_endo -74.35 142.5 30.15 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 122.09 1.86 . . . . 0.0 111.391 174.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.515 ' HB3' ' CE1' ' A' ' 99' ' ' TYR . 25.2 pttm -140.31 153.46 46.46 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.9 mt -84.92 142.82 29.4 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.624 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.1 m -136.2 148.63 27.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.077 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.529 HG22 ' HE1' ' A' ' 49' ' ' MET . 4.5 t -103.64 114.12 42.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.355 0.598 . . . . 0.0 110.263 176.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -114.43 96.17 5.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.647 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.82 -112.28 3.88 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.585 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -117.46 16.09 14.69 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.143 0.497 . . . . 0.0 110.278 176.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 15.3 m -124.18 136.95 54.55 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.147 177.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.455 HG12 HG22 ' A' ' 89' ' ' VAL . 58.2 mt -94.51 135.18 29.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.56 178.61 6.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.077 0.465 . . . . 0.0 110.799 -173.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 69.3 mt -118.94 130.26 74.01 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.291 -176.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.401 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 0.0 OUTLIER -126.06 176.38 7.06 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.352 -177.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.437 ' HD2' ' CB ' ' A' ' 83' ' ' TYR . 5.0 m-85 -128.71 149.94 50.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.767 0.318 . . . . 0.0 110.736 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.515 ' CE1' ' HB3' ' A' ' 86' ' ' LYS . 51.3 p90 -139.95 152.54 46.42 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.426 ' HG3' ' CE2' ' A' ' 83' ' ' TYR . 2.5 mp0 -61.27 134.2 56.71 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.982 0.42 . . . . 0.0 111.236 -178.351 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.6 t -53.38 123.21 35.02 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.448 175.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.77 -25.52 79.48 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.829 2.352 . . . . 0.0 112.176 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 50.8 t -67.81 -19.95 25.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.871 179.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -76.77 -18.12 58.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.391 0.615 . . . . 0.0 109.882 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -103.35 97.57 7.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.866 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 66.3 mttm . . . . . 0 C--N 1.322 -0.6 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.809 -177.53 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 120.998 0.428 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.445 ' HA ' ' HD2' ' A' ' 3' ' ' PRO . 44.7 mt-10 -115.24 88.22 17.79 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.945 174.011 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.445 ' HD2' ' HA ' ' A' ' 2' ' ' GLU . 6.6 Cg_endo -47.77 115.79 1.61 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.267 2.644 . . . . 0.0 112.264 -177.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.3 mm -88.23 103.92 14.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.199 0.523 . . . . 0.0 111.182 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -143.76 -168.79 12.43 Favored Glycine 0 N--CA 1.447 -0.612 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 176.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -151.08 135.73 17.15 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 117.857 0.829 . . . . 0.0 111.146 177.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 19.8 m -79.82 101.63 8.62 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.573 175.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 89.3 mt -44.11 -62.56 1.1 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.936 0.773 . . . . 0.0 112.778 -173.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -104.31 -3.79 23.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.911 0.386 . . . . 0.0 111.323 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -101.59 56.71 0.69 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.552 -176.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.8 t -101.13 -47.66 11.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.04 0.448 . . . . 0.0 110.45 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.0 t -60.59 -27.51 67.78 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.484 -178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.419 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -159.74 151.39 22.12 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.986 -0.626 . . . . 0.0 111.671 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.419 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.5 OUTLIER -143.2 73.83 17.77 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -77.54 161.3 31.3 Favored 'Trans proline' 0 N--CA 1.464 -0.234 0 C-N-CA 122.712 2.275 . . . . 0.0 112.039 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.618 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 2.4 p-10 -68.38 -27.25 66.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 177.207 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -49.6 -49.58 46.2 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.457 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.09 -33.26 75.37 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.681 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 26.0 mmtp -73.55 -29.44 62.44 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.618 ' HG2' ' O ' ' A' ' 16' ' ' ASP . 13.7 mmm-85 -68.37 -46.47 69.99 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 172.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.7 tp -55.57 -48.88 74.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.116 177.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -65.56 -39.14 91.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.017 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.52 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 32.3 tp60 -63.76 -52.1 61.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.764 -177.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.518 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.8 ptm -66.63 -38.28 86.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.48 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -59.46 -44.22 93.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.178 0.513 . . . . 0.0 109.931 177.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.466 ' HA ' ' HG2' ' A' ' 29' ' ' MET . 33.1 tt0 -67.07 -44.41 80.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.318 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -52.29 -51.01 61.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.215 177.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 24' ' ' MET . 85.5 t -59.06 -41.82 84.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.944 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.466 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 21.7 ptp -85.52 14.91 4.99 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -176.113 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.414 ' HD3' ' HG2' ' A' ' 26' ' ' GLU . 3.6 mptp? -119.45 -2.33 10.58 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 176.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.681 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 29.6 t70 -85.3 135.11 34.05 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.617 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.52 ' HG3' ' N ' ' A' ' 33' ' ' ASP . 5.1 pt20 -63.34 -41.16 98.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.073 -176.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.52 ' N ' ' HG3' ' A' ' 32' ' ' GLN . 11.9 m-20 -74.12 -33.1 63.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.022 0.439 . . . . 0.0 110.001 -175.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.13 -43.9 93.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.047 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.681 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 71.2 mm-40 -56.44 -50.32 72.02 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.269 0.557 . . . . 0.0 110.496 177.614 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -56.9 -45.66 82.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.424 -178.061 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -67.34 -41.35 85.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.136 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.456 HD11 HD11 ' A' ' 50' ' ' ILE . 1.9 mm? -57.82 -43.83 86.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.449 -178.514 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.544 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.6 ptmm? -82.8 -22.04 34.33 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.753 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 1.1 tm-20 -65.92 -39.56 90.66 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -116.81 32.48 6.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.843 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.544 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 10.7 pt-20 -61.43 -22.5 65.08 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.073 0.463 . . . . 0.0 111.181 -178.028 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -77.62 -34.63 53.29 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 177.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.3 t -93.29 -39.36 10.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.394 -171.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.532 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 76.1 mt -71.61 142.97 14.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.24 0.543 . . . . 0.0 111.434 -174.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -120.81 166.02 14.34 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.031 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 57.4 mt-30 -57.69 -44.17 85.63 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.241 0.543 . . . . 0.0 109.963 174.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -63.71 -38.33 90.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.029 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.532 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 50.7 ttm -57.01 -39.16 74.19 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.255 177.144 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.456 HD11 HD11 ' A' ' 38' ' ' LEU . 45.7 mm -67.27 -42.06 87.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.879 178.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 42.7 mm-40 -66.88 -43.28 83.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.129 0.49 . . . . 0.0 110.417 -178.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -67.57 -30.24 69.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.3 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.501 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.5 m -109.0 19.1 19.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.262 -175.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 mt -59.76 -46.6 88.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.053 0.454 . . . . 0.0 110.427 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -57.73 -39.84 78.24 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.856 176.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.576 ' O ' HD11 ' A' ' 96' ' ' ILE . 4.9 mmpt? -67.66 -51.05 54.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.139 0.495 . . . . 0.0 110.283 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 53' ' ' SER . 90.3 mt -62.24 -41.65 98.61 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.127 -177.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -69.49 -43.97 72.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.414 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.574 ' HG3' ' NE2' ' A' ' 63' ' ' GLN . 11.1 tp10 -56.44 -39.38 73.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.135 0.493 . . . . 0.0 109.892 175.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.442 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 56.2 t80 -56.52 -52.61 64.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.917 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.54 ' HA ' ' HD3' ' A' ' 65' ' ' LYS . 32.9 pt -75.53 -30.57 22.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -77.61 -19.62 55.25 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 111.283 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.574 ' NE2' ' HG3' ' A' ' 59' ' ' GLU . 46.0 mt-30 -78.79 -171.54 2.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.163 0.506 . . . . 0.0 110.756 175.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.2 p -75.64 99.74 4.41 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.423 178.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.54 ' HD3' ' HA ' ' A' ' 61' ' ' ILE . 12.3 mmmm -63.78 -26.49 68.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.206 0.527 . . . . 0.0 110.265 176.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.539 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.5 t-20 -112.63 -165.65 1.01 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.568 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -148.09 154.53 40.33 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.902 178.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.657 ' HA ' ' O ' ' A' ' 71' ' ' SER . 25.6 t -67.78 -20.62 65.22 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.236 -175.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.416 ' HB2' ' HA2' ' A' ' 82' ' ' GLY . 8.2 t80 -69.44 -13.67 62.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 111.601 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.539 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 24.6 p -123.33 -33.69 3.22 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.696 -0.401 . . . . 0.0 110.534 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.657 ' O ' ' HA ' ' A' ' 68' ' ' SER . 39.5 m -125.29 103.79 8.13 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -85.66 61.24 6.73 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.904 0.859 . . . . 0.0 110.614 -173.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -85.37 139.42 31.58 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.511 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -86.54 -21.76 26.73 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.656 -174.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -90.28 -34.02 15.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.694 0.283 . . . . 0.0 111.228 -174.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.67 120.41 11.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.109 0.481 . . . . 0.0 111.496 -178.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -77.64 92.89 4.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.551 ' OD1' ' HA ' ' A' ' 81' ' ' GLU . 2.4 t-20 -100.43 117.9 35.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.715 178.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.1 mt -74.06 -74.46 0.19 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.466 -176.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.0 mp -85.57 96.78 9.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 174.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.619 ' HG3' ' HB3' ' A' ' 68' ' ' SER . 30.7 tt0 -72.62 124.71 25.82 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.176 0.512 . . . . 0.0 110.173 -177.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.416 ' HA2' ' HB2' ' A' ' 69' ' ' TYR . . . 103.88 -7.74 49.45 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.333 -176.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.576 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 15.5 m-85 -121.37 162.01 21.12 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 178.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.0 m170 -124.68 150.88 66.69 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 173.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.435 ' HB2' ' CD1' ' A' ' 60' ' ' TYR . 55.5 Cg_endo -71.39 141.44 38.81 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.672 2.248 . . . . 0.0 111.536 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.611 ' HB2' ' CD1' ' A' ' 99' ' ' TYR . 86.4 tttt -131.47 131.14 43.27 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.568 -172.281 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.476 HD12 ' HA ' ' A' ' 87' ' ' LEU . 0.4 OUTLIER -85.76 125.98 33.65 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.254 177.429 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.619 HG11 ' HG3' ' A' ' 97' ' ' GLU . 29.5 m -131.26 145.21 35.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.668 0.271 . . . . 0.0 110.882 178.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.4 p -95.52 120.42 44.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.259 0.552 . . . . 0.0 110.024 176.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -121.96 96.3 5.0 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.866 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.65 -104.31 1.59 Allowed Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.151 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -116.57 5.71 13.34 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.565 0.221 . . . . 0.0 111.175 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.1 p -130.01 159.86 35.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.975 0.417 . . . . 0.0 111.35 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.9 mt -110.28 137.9 40.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.92 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.508 ' HA ' ' HD3' ' A' ' 56' ' ' LYS . 1.8 t0 -126.97 178.92 5.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.879 0.371 . . . . 0.0 110.63 -175.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.576 HD11 ' O ' ' A' ' 56' ' ' LYS . 44.8 mt -123.1 112.61 34.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.195 -176.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.619 ' HG3' HG11 ' A' ' 88' ' ' VAL . 3.7 mm-40 -98.61 -175.11 2.98 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.272 174.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.576 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 3.3 m-85 -139.67 124.03 18.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 174.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.611 ' CD1' ' HB2' ' A' ' 86' ' ' LYS . 39.0 p90 -110.41 147.02 34.85 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 176.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.538 ' H ' ' CD ' ' A' ' 100' ' ' GLU . 2.3 pm0 -66.44 135.06 53.73 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.478 0.656 . . . . 0.0 110.713 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.457 ' SG ' HG12 ' A' ' 103' ' ' VAL . 21.3 t -44.52 124.67 4.75 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 114.195 -1.366 . . . . 0.0 111.857 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -59.32 -10.23 10.34 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 123.339 2.693 . . . . 0.0 113.435 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.457 HG12 ' SG ' ' A' ' 101' ' ' CYS . 8.7 p -66.57 -18.33 23.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.035 0.445 . . . . 0.0 110.625 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.412 ' HD2' ' HA ' ' A' ' 104' ' ' LYS . 13.1 mmmm -78.16 -24.19 47.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.894 176.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -133.97 75.96 1.63 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.311 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.257 178.279 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.0 ttm . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 2.7 mp0 -62.71 145.09 95.95 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.856 -177.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 2' ' ' GLU . 14.5 Cg_exo -68.32 95.04 0.43 Allowed 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.894 2.396 . . . . 0.0 112.874 -177.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.8 tp -116.94 112.5 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.749 172.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -95.21 -50.21 2.09 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.407 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -81.67 89.19 6.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.076 0.465 . . . . 0.0 110.804 -178.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 34.5 p -103.43 169.28 8.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.834 177.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 89.3 mt -106.31 7.63 31.39 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.994 0.426 . . . . 0.0 110.815 -176.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -91.42 23.26 3.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.068 -179.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -133.92 79.72 0.33 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.966 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 63.4 t -62.72 110.12 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.944 0.402 . . . . 0.0 110.47 -179.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.4 p -140.61 176.35 8.85 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.017 -177.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.451 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -77.52 176.04 53.84 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.975 174.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.451 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.2 OUTLIER -141.38 84.11 12.89 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-O 120.9 0.381 . . . . 0.0 110.434 -177.888 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.411 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 22.1 Cg_endo -62.73 124.27 13.81 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.553 2.168 . . . . 0.0 111.62 173.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.426 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 11.4 m-20 -61.51 -29.59 70.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.263 -176.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.81 -51.71 67.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.142 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.42 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -70.66 -31.18 68.01 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.313 -177.79 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.462 ' HE3' ' HB3' ' A' ' 19' ' ' LYS . 21.1 mtpp -66.59 -48.77 68.49 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.966 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.506 ' O ' ' HG2' ' A' ' 24' ' ' MET . 7.2 ptm180 -68.47 -31.69 71.16 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 37.2 tp -62.86 -50.28 71.53 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -59.66 -45.13 92.95 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 120.952 0.406 . . . . 0.0 110.31 176.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -59.1 -57.76 11.62 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.385 -175.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.506 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 25.3 ptm -66.74 -38.3 86.39 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.39 -177.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 25' ' ' LYS . 17.0 tptm -64.81 -41.46 95.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.004 0.431 . . . . 0.0 110.292 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.526 ' HG3' ' HD3' ' A' ' 30' ' ' LYS . 23.4 tt0 -61.83 -50.63 71.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.557 177.004 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -54.41 -42.27 70.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.303 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 24' ' ' MET . 87.0 t -68.87 -42.75 82.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.968 0.413 . . . . 0.0 110.953 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 44.4 mtt -78.69 -6.93 57.09 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -175.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.526 ' HD3' ' HG3' ' A' ' 26' ' ' GLU . 2.1 mptm? -103.26 -4.08 24.78 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -178.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.703 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 25.2 t70 -83.41 134.0 34.9 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.843 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -66.25 -41.34 90.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.851 -175.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -74.32 -35.49 63.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.776 0.322 . . . . 0.0 110.393 -174.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.8 t -55.67 -47.65 78.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.774 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.703 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 35.1 mt-30 -65.02 -31.75 73.13 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.155 0.502 . . . . 0.0 110.88 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.34 -46.49 88.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.464 176.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -65.52 -42.35 92.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.407 176.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.434 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.8 mm? -57.36 -44.43 84.35 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.703 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -73.75 -28.18 61.55 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.923 -177.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -66.47 -55.71 14.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.619 0.723 . . . . 0.0 110.474 178.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -102.47 30.23 4.74 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.627 -174.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -60.4 -27.41 67.43 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.124 -177.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -85.79 -24.1 26.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.885 0.374 . . . . 0.0 111.122 -179.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 22.0 t -93.4 -35.15 6.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.277 0.56 . . . . 0.0 111.147 -172.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.48 HG23 ' HE2' ' A' ' 49' ' ' MET . 50.7 mt -88.27 150.99 3.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.522 -178.004 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -119.34 163.2 17.53 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 29.9 mm-40 -59.61 -39.06 82.98 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.606 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -64.52 -38.05 89.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.045 0.45 . . . . 0.0 110.554 178.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.48 ' HE2' HG23 ' A' ' 45' ' ' ILE . 2.1 ttp -67.43 -31.93 72.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.224 178.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.0 mm -63.69 -46.39 94.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.256 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 9.7 mm-40 -67.37 -40.46 85.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.74 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -66.68 -43.52 84.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.02 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.401 ' HB2' HD12 ' A' ' 94' ' ' ILE . 50.6 m -98.98 19.31 15.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.002 -178.2 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 42.8 tp -63.06 -30.12 71.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -61.83 -38.08 86.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.02 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 17.1 mmtm -74.95 -40.64 60.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.321 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.09 -41.06 97.8 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.331 0.586 . . . . 0.0 110.167 175.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -69.62 -44.47 70.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.539 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.487 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 45.3 tt0 -64.13 -35.4 80.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.344 178.111 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.541 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 26.3 t80 -56.15 -56.1 25.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.369 177.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.1 pt -69.31 -30.99 47.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.09 -174.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 11.0 pt-20 -80.53 -24.97 38.95 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.142 -0.623 . . . . 0.0 112.241 -174.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 58.5 mt-30 -77.76 -32.4 52.6 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.833 -176.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.455 ' OG ' ' HB2' ' A' ' 78' ' ' ASN . 10.9 m -178.84 118.37 0.07 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.047 -175.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.71 -51.79 6.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.8 0.81 . . . . 0.0 109.088 169.097 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.533 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 30.7 p30 -115.71 -157.81 0.66 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.948 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.482 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 8.2 p -152.62 163.55 39.41 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 44.4 t -54.92 -31.13 59.94 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 123.829 0.706 . . . . 0.0 111.286 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.458 ' HB2' ' HA2' ' A' ' 82' ' ' GLY . 0.1 OUTLIER -75.36 4.97 6.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.286 -0.416 . . . . 0.0 112.036 -178.656 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 66' ' ' ASN . 31.9 p -151.64 19.25 0.71 Allowed 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.141 0.496 . . . . 0.0 110.352 175.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.6 t -129.65 153.38 48.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.414 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.5 tp10 -77.44 -27.1 52.05 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -84.6 129.25 34.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.349 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.96 -4.86 5.06 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.564 174.013 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -75.51 -40.56 56.93 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.209 -175.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 26.4 p -152.07 26.18 0.62 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.866 0.365 . . . . 0.0 110.934 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -68.89 -60.44 2.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.253 -173.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.482 ' OD1' ' HA ' ' A' ' 67' ' ' CYS . 1.3 p-10 -160.97 156.98 25.61 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.28 -0.418 . . . . 0.0 109.928 -177.186 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -74.06 -56.81 4.48 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.789 0.328 . . . . 0.0 111.161 -174.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 29.1 mt -82.29 81.25 8.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.43 0.633 . . . . 0.0 111.058 -176.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -64.59 129.34 39.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.767 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.458 ' HA2' ' HB2' ' A' ' 69' ' ' TYR . . . 97.52 -9.02 64.47 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.346 178.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.73 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 44.7 m-85 -125.0 157.93 34.94 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 111.394 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.533 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 12.5 m170 -129.61 155.29 80.51 Favored Pre-proline 0 CA--C 1.51 -0.59 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 171.121 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.541 ' O ' ' HE1' ' A' ' 60' ' ' TYR . 38.2 Cg_endo -77.81 151.61 28.17 Favored 'Trans proline' 0 N--CA 1.446 -1.318 0 C-N-CA 122.096 1.864 . . . . 0.0 110.717 172.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 31.5 ttpt -144.83 141.35 29.07 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 176.274 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.466 HD22 ' H ' ' A' ' 87' ' ' LEU . 1.8 mm? -78.7 140.01 38.4 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 32.2 m -132.26 147.84 32.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 175.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 p -98.17 114.4 35.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.406 0.622 . . . . 0.0 110.298 178.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -117.42 96.32 5.35 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.556 178.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.83 -107.38 2.07 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.066 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -116.96 19.16 14.46 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.218 0.533 . . . . 0.0 110.482 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.8 p -135.42 141.77 45.5 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.234 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.401 HD12 ' HB2' ' A' ' 53' ' ' SER . 68.1 mt -96.54 131.84 42.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.116 178.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -120.48 178.13 4.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.636 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 70.8 mt -132.93 114.53 22.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.851 0.357 . . . . 0.0 110.934 -176.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 9.4 pt-20 -103.13 -177.05 3.26 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.3 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.73 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 2.9 m-85 -130.25 123.61 30.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.107 0.48 . . . . 0.0 110.587 175.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.467 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 51.2 p90 -112.75 151.88 29.77 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 176.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.412 ' HA ' ' HA ' ' A' ' 83' ' ' TYR . 5.4 pt-20 -84.42 133.26 34.51 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.744 0.783 . . . . 0.0 111.467 -178.15 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 6.6 t -46.8 123.49 7.65 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.803 -178.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.93 -10.79 29.7 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.801 2.334 . . . . 0.0 112.442 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 59.6 t -69.0 -20.44 24.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.925 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 101' ' ' CYS . 22.3 ptmt -67.87 -23.65 65.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.683 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -105.13 119.56 39.33 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.206 0.527 . . . . 0.0 110.132 177.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.694 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.636 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.103 0 CA-C-O 121.064 0.459 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -72.85 147.41 88.8 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.633 -175.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.0 105.06 0.21 Allowed 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.728 2.285 . . . . 0.0 111.05 175.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 65.1 mt -60.1 122.7 11.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.339 -174.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -134.09 119.06 2.16 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 177.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.434 ' HG3' ' H ' ' A' ' 8' ' ' LEU . 15.9 tpt180 -89.39 134.41 34.09 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 -177.526 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.7 m -63.31 -21.56 66.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.3 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.434 ' H ' ' HG3' ' A' ' 6' ' ' ARG . 41.0 mt -83.02 87.97 6.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.089 0.471 . . . . 0.0 111.31 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -83.84 -47.66 10.86 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 171.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -131.4 109.08 0.85 Allowed Glycine 0 N--CA 1.444 -0.789 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.562 175.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.452 HG12 ' HG3' ' A' ' 14' ' ' ARG . 17.3 t -75.2 98.64 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 120.817 0.341 . . . . 0.0 110.383 -177.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 t -82.93 -38.13 23.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.685 -177.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -104.75 131.12 10.5 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.508 -0.854 . . . . 0.0 111.487 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.452 ' HG3' HG12 ' A' ' 11' ' ' VAL . 0.1 OUTLIER -143.69 65.09 14.07 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.918 0.359 . . . . 0.0 110.675 -177.655 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.511 ' HB2' ' HG2' ' A' ' 18' ' ' GLN . 28.7 Cg_exo -62.02 105.61 0.4 Allowed 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.314 2.01 . . . . 0.0 111.524 173.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -55.71 -37.37 68.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.231 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -54.58 -56.16 21.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.685 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.531 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 2.9 pt20 -71.5 -30.29 65.79 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.733 -177.218 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 29.9 mtpp -59.01 -47.92 83.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.533 178.093 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.403 ' HD3' HH11 ' A' ' 20' ' ' ARG . 19.7 ptt180 -77.49 -29.98 52.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.694 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.531 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 23.5 tp -61.1 -50.02 74.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.899 179.295 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 21.8 mm-40 -75.68 -27.2 58.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.097 178.438 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 34.1 tt0 -62.25 -54.87 34.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.931 0.396 . . . . 0.0 110.551 178.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.499 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.3 ptm -65.67 -36.99 85.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.025 177.211 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.422 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 11.7 tptm -54.3 -49.33 69.91 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.695 175.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -60.14 -48.3 82.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.996 -175.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -57.34 -40.3 77.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.111 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 24' ' ' MET . 60.7 t -70.96 -33.89 53.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.168 0.509 . . . . 0.0 110.393 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.5 mmt -71.03 -14.01 62.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.125 -176.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.77 14.51 12.56 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.693 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 18.3 t70 -85.31 135.48 33.89 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.549 176.306 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -63.99 -47.31 80.84 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.83 -175.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -70.48 -34.04 71.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.893 0.377 . . . . 0.0 110.405 -175.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 76.4 t -58.59 -43.23 86.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.761 174.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.693 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 61.9 mm-40 -59.59 -49.06 79.22 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.171 0.51 . . . . 0.0 110.527 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.52 -43.48 75.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.609 -177.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.505 ' CE2' HD11 ' A' ' 45' ' ' ILE . 78.3 t80 -72.28 -40.98 67.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.057 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.92 HD11 HD11 ' A' ' 50' ' ' ILE . 1.9 mm? -60.11 -45.54 92.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.538 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -73.71 -26.15 60.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.536 -178.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -66.35 -54.92 18.97 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.384 0.612 . . . . 0.0 110.307 176.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -105.69 32.64 4.2 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.483 -173.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -62.43 -24.45 67.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.944 0.402 . . . . 0.0 111.178 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -68.5 -36.42 78.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.336 0.588 . . . . 0.0 110.011 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 15.4 t -93.9 -43.21 13.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.83 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.505 HD11 ' CE2' ' A' ' 37' ' ' PHE . 67.9 mt -75.63 144.21 12.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.864 -176.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -131.25 176.72 8.04 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.413 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 99.3 mt-30 -59.74 -39.93 86.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.763 0.316 . . . . 0.0 111.82 -177.446 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -72.8 -36.8 67.66 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.935 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.484 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 53.6 ttm -56.47 -36.58 69.25 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 174.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.92 HD11 HD11 ' A' ' 38' ' ' LEU . 37.2 mm -61.48 -54.71 31.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.996 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.734 ' HA ' HD23 ' A' ' 54' ' ' LEU . 29.7 mt-10 -68.82 -34.6 75.78 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -178.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.4 tptp -65.02 -26.54 68.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.906 0.384 . . . . 0.0 110.525 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -115.2 16.36 16.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.38 -178.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.734 HD23 ' HA ' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -58.83 -41.16 86.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.613 -178.685 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -55.48 -43.77 75.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.436 176.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.505 ' O ' HD11 ' A' ' 96' ' ' ILE . 33.2 mmtp -71.49 -48.38 49.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.861 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.57 -42.26 87.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.034 0.445 . . . . 0.0 110.753 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -70.08 -39.44 75.59 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.423 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.01 -40.13 92.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.038 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.457 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 70.0 t80 -63.25 -50.49 69.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.979 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.1 pt -70.28 -31.27 46.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -171.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -85.38 -25.67 26.92 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.335 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.457 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 0.8 OUTLIER -75.06 160.99 29.83 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.603 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.9 p -64.1 120.52 12.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.696 0.284 . . . . 0.0 111.39 -176.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HD3' ' O ' ' A' ' 65' ' ' LYS . 3.0 tmtp? -73.64 -31.74 63.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.526 0.679 . . . . 0.0 109.168 177.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -84.73 -165.4 1.17 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.215 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 p -157.8 159.85 37.17 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 176.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.446 ' HB2' ' HB2' ' A' ' 76' ' ' CYS . 22.8 t -67.42 -23.43 65.55 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.054 0.454 . . . . 0.0 110.509 -172.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -68.1 -9.09 43.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.696 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.2 p -133.42 1.24 3.42 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 28.8 m -122.64 140.51 52.75 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -81.09 57.3 3.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.928 0.87 . . . . 0.0 110.407 -177.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -154.32 124.71 6.95 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.231 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -100.35 0.16 39.47 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.357 -176.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -88.45 53.24 2.66 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.467 ' SG ' ' HB3' ' A' ' 78' ' ' ASN . 49.7 t -84.55 129.98 34.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.59 -1.187 . . . . 0.0 111.154 -172.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -80.13 -17.42 52.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.001 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.467 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 39.0 t30 -57.97 136.86 57.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.508 -177.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.7 mt -81.86 -56.52 3.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.859 -179.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.417 ' HB2' ' CE2' ' A' ' 98' ' ' TYR . 3.9 mm? -85.34 79.36 9.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.715 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -73.5 138.71 45.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.562 0.696 . . . . 0.0 110.67 -176.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.55 -8.58 68.91 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.956 -171.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.462 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 74.4 m-85 -122.78 168.91 11.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 178.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.415 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 15.7 m170 -128.41 149.12 70.69 Favored Pre-proline 0 C--O 1.236 0.383 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 170.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -70.74 142.67 44.14 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.78 2.32 . . . . 0.0 112.866 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.484 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 16.6 ttmm -133.48 137.19 45.55 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.179 177.099 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.1 mt -83.66 130.63 34.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.198 176.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.425 HG21 ' HG2' ' A' ' 97' ' ' GLU . 16.0 m -132.11 149.86 33.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.48 178.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.6 p -97.64 118.03 43.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.201 0.524 . . . . 0.0 110.697 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -122.31 98.04 5.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.014 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.53 -112.01 4.58 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.995 -177.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.46 ' HD3' ' HE2' ' A' ' 49' ' ' MET . 17.7 mmt180 -112.6 15.49 20.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.155 0.503 . . . . 0.0 110.512 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.9 p -125.78 131.12 52.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.075 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.5 mt -91.04 129.16 42.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -119.27 177.83 4.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.952 0.406 . . . . 0.0 110.847 -170.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.505 HD11 ' O ' ' A' ' 56' ' ' LYS . 56.5 mt -127.7 106.87 15.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.587 -177.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.425 ' HG2' HG21 ' A' ' 88' ' ' VAL . 57.3 mm-40 -97.31 178.9 5.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.433 176.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 80' ' ' LEU . 24.4 m-85 -132.16 130.71 41.45 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.159 0.504 . . . . 0.0 111.12 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.484 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 38.0 p90 -113.41 150.87 32.1 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.381 174.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.462 ' HG2' ' CE1' ' A' ' 83' ' ' TYR . 36.8 mt-10 -64.62 131.48 47.1 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.657 0.265 . . . . 0.0 110.907 -177.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.518 ' SG ' HG12 ' A' ' 103' ' ' VAL . 47.7 t -44.63 122.56 4.54 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.889 177.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.53 -12.67 21.82 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 123.241 2.627 . . . . 0.0 113.849 -175.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.518 HG12 ' SG ' ' A' ' 101' ' ' CYS . 4.5 p -67.77 -19.02 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 120.765 0.316 . . . . 0.0 110.525 178.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -66.9 -21.82 65.99 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 121.068 0.461 . . . . 0.0 110.515 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -78.04 91.33 4.25 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 178.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm . . . . . 0 C--N 1.322 -0.619 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.914 -175.856 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.406 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 26.6 ptt? . . . . . 0 N--CA 1.482 1.139 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -115.68 86.83 16.35 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 177.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 1' ' ' MET . 8.3 Cg_exo -71.96 110.03 2.82 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 123.049 2.499 . . . . 0.0 112.673 -176.083 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.8 mm -87.84 -31.88 5.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.614 0.721 . . . . 0.0 109.51 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -82.43 63.86 4.36 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.882 178.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -97.87 2.64 49.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.944 0.402 . . . . 0.0 111.057 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.2 m -81.95 68.52 8.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.023 0.44 . . . . 0.0 110.422 178.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 8' ' ' LEU . 3.2 mm? -75.85 4.46 8.04 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.486 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -78.17 -34.76 49.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 61.88 -163.31 24.87 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 115.639 -0.709 . . . . 0.0 113.244 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.9 m -136.51 124.11 33.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.868 0.366 . . . . 0.0 110.115 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.2 t -74.96 -26.54 59.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.11 0.481 . . . . 0.0 110.519 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -100.11 129.09 9.78 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 176.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -143.79 84.33 9.89 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-O 121.344 0.592 . . . . 0.0 111.206 -175.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.676 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 55.2 Cg_endo -70.36 134.98 27.95 Favored 'Trans proline' 0 C--N 1.331 -0.365 0 C-N-CA 123.389 2.726 . . . . 0.0 111.913 174.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.55 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 2.1 p-10 -72.55 -22.6 60.98 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -55.48 -53.06 61.06 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.539 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.676 ' HG2' ' HG2' ' A' ' 15' ' ' PRO . 2.0 pt20 -63.66 -31.23 72.33 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.888 -177.492 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.55 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 43.1 mtmt -64.36 -36.67 84.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.576 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.466 ' O ' ' HG2' ' A' ' 24' ' ' MET . 8.6 mtt180 -71.77 -50.65 28.05 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.457 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.8 tp -54.21 -49.64 68.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.049 -175.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -74.67 -34.58 62.71 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.97 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 46.8 tt0 -63.44 -56.19 18.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.777 0.323 . . . . 0.0 110.862 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.608 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.4 ptm -61.7 -37.64 84.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.747 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.551 ' HA ' ' HE3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -66.93 -44.55 80.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.154 178.707 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -65.03 -37.21 86.86 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -58.06 -44.16 87.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.698 175.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 24' ' ' MET . 78.1 t -64.62 -36.08 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.956 178.17 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.456 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 88.9 mmm -84.97 0.14 52.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.071 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.87 -35.99 13.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.436 0.636 . . . . 0.0 110.331 175.27 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.692 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 21.7 t70 -62.56 123.49 18.48 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.154 -171.307 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.439 ' H ' ' CD ' ' A' ' 32' ' ' GLN . 18.0 mp0 -60.65 -41.25 94.6 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.395 -176.547 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -63.12 -46.85 85.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.918 -177.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.8 t -54.93 -47.11 76.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.404 176.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.692 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 55.5 mt-30 -62.31 -40.63 96.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.5 -176.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.54 -40.26 82.49 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.562 177.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.459 ' CE2' HD11 ' A' ' 45' ' ' ILE . 88.5 t80 -69.56 -39.79 77.18 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.397 177.274 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.579 HD11 HD11 ' A' ' 50' ' ' ILE . 2.6 mm? -63.08 -44.91 94.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.756 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -68.51 -29.12 67.65 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.104 0.478 . . . . 0.0 110.527 -177.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.47 -30.42 37.43 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.987 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -119.14 26.55 9.41 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -65.4 -17.64 64.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.097 0.475 . . . . 0.0 110.18 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.84 -31.76 69.81 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.118 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.5 t -108.19 -35.43 2.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.492 -172.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.459 HD11 ' CE2' ' A' ' 37' ' ' PHE . 68.9 mt -78.3 135.67 25.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.558 0.694 . . . . 0.0 111.516 -175.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -111.44 164.98 12.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.74 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.401 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 76.7 mt-30 -61.51 -37.23 82.94 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.347 0.594 . . . . 0.0 109.658 173.275 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -63.07 -42.2 99.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.276 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 33.6 tpp -56.21 -42.29 76.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.289 176.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.579 HD11 HD11 ' A' ' 38' ' ' LEU . 35.9 mm -60.32 -39.35 80.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.517 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.516 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 41.8 mt-10 -65.58 -49.19 69.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.487 176.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -60.65 -47.16 87.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.14 -177.027 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.3 p -92.79 17.66 10.1 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.329 -175.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.516 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -52.45 -49.37 64.76 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.96 0.409 . . . . 0.0 110.786 -179.473 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -61.74 -42.32 98.81 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.681 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -61.15 -51.36 69.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.806 0.336 . . . . 0.0 110.388 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 57' ' ' LEU . 3.9 mm? -59.95 -43.31 95.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.054 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -66.21 -42.62 88.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.411 -177.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -59.59 -36.43 76.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.352 0.596 . . . . 0.0 110.021 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -67.23 -45.38 76.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.885 -178.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.6 pt -75.36 -31.4 23.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -174.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -81.07 -27.05 35.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.589 0.233 . . . . 0.0 111.29 -177.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -80.25 173.99 12.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.055 0.455 . . . . 0.0 111.117 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.6 m -76.7 116.04 17.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.704 -179.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -81.02 -35.76 31.47 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.129 0.49 . . . . 0.0 110.111 176.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -79.86 -177.02 5.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.952 177.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -150.79 156.81 42.02 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.632 -177.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.492 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 33.1 t -66.98 -19.01 65.65 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.223 -172.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.483 ' CE1' ' HA ' ' A' ' 104' ' ' LYS . 1.2 t80 -75.9 -2.23 29.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.066 0.46 . . . . 0.0 111.305 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 17.6 p -132.24 -44.28 0.94 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.559 176.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.6 p -80.53 152.09 28.84 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -81.97 -9.79 59.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.818 0.342 . . . . 0.0 110.768 -176.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASP . . . . . 0.482 ' HB2' ' HB2' ' A' ' 76' ' ' CYS . 7.4 m-20 -55.0 111.82 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.222 -175.161 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -70.4 -21.74 62.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.449 0.643 . . . . 0.0 109.273 171.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -86.98 4.84 40.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.563 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.482 ' HB2' ' HB2' ' A' ' 73' ' ' ASP . 45.8 t -69.3 114.37 7.48 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.07 0.462 . . . . 0.0 110.506 -178.211 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -117.22 143.85 45.43 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -160.49 168.41 25.15 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.0 mt -75.26 -79.22 0.1 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 8.0 mp -88.34 93.86 9.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.206 173.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.492 ' CD ' ' H ' ' A' ' 68' ' ' SER . 2.2 mm-40 -76.19 151.52 36.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.354 0.597 . . . . 0.0 110.714 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.38 -9.74 72.01 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.028 -170.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.559 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 64.9 m-85 -122.47 172.12 8.59 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.491 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 14.5 m170 -128.92 144.35 52.19 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 172.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -75.34 130.76 13.22 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.446 2.097 . . . . 0.0 111.252 174.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.557 ' HD3' ' CD1' ' A' ' 99' ' ' TYR . 19.9 pttp -134.99 148.5 49.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.007 0.432 . . . . 0.0 109.994 175.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.415 HD23 HG12 ' A' ' 96' ' ' ILE . 73.2 mt -81.26 141.62 33.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.346 -175.663 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.7 m -135.95 154.23 33.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.562 175.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.6 p -107.05 114.02 45.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.343 0.592 . . . . 0.0 110.346 176.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -125.89 101.97 7.07 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.302 -177.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.73 -118.5 9.86 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.211 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 92' ' ' ARG . 20.7 tpp180 -105.2 19.52 20.45 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.978 0.894 . . . . 0.0 109.947 -179.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 43.3 t -136.16 136.53 40.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.25 0.548 . . . . 0.0 111.433 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 86.3 mt -89.61 119.54 36.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 169.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.57 177.71 4.54 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.852 0.358 . . . . 0.0 110.634 -172.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.415 HG12 HD23 ' A' ' 87' ' ' LEU . 53.3 mt -131.64 115.98 29.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.309 -177.262 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -119.03 163.28 17.21 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 174.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.559 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 30.3 m-85 -103.92 141.21 36.55 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.096 -176.437 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.557 ' CD1' ' HD3' ' A' ' 86' ' ' LYS . 53.6 p90 -117.69 147.55 42.81 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 173.08 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.479 ' HG2' ' CE2' ' A' ' 83' ' ' TYR . 31.5 mt-10 -62.58 125.83 25.27 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.395 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.619 ' HB3' ' HB2' ' A' ' 104' ' ' LYS . 40.0 t -47.31 132.43 9.82 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.235 175.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -55.58 -29.29 69.26 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 122.537 2.158 . . . . 0.0 112.085 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.0 t -80.16 -17.9 12.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.38 178.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.619 ' HB2' ' HB3' ' A' ' 101' ' ' CYS . 14.2 tmtt? -81.67 -34.89 30.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.524 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 54.0 mtm180 -73.88 99.64 3.28 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.394 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 20.5 pttp . . . . . 0 C--N 1.319 -0.735 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.511 -176.023 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 121.211 0.529 . . . . 0.0 110.335 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -142.96 165.81 24.03 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.558 -176.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.54 86.86 0.27 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 121.95 1.767 . . . . 0.0 110.78 170.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.1 mm -79.12 -40.13 21.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.078 -176.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 159.69 128.18 0.96 Allowed Glycine 0 N--CA 1.443 -0.839 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.487 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.65 14.82 27.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.221 0.534 . . . . 0.0 110.577 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.4 t -118.05 99.31 6.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.308 177.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -76.04 -41.54 50.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.144 0.497 . . . . 0.0 109.726 -177.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.409 ' H ' ' CD ' ' A' ' 9' ' ' GLN . 0.5 OUTLIER -108.5 -175.0 2.65 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.01 -178.005 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -100.83 91.8 1.0 Allowed Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.515 177.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.4 t -61.72 106.27 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.137 0.494 . . . . 0.0 110.5 -178.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -107.67 8.81 29.22 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.918 -176.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.465 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -119.63 117.08 3.48 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 175.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.465 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.0 OUTLIER -143.49 85.24 9.55 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 -177.051 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.446 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 20.3 Cg_endo -60.97 154.48 56.38 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.951 2.434 . . . . 0.0 111.996 176.394 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -58.44 -28.4 65.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.892 -178.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -55.85 -50.54 70.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.395 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -71.2 -34.3 70.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.895 0.378 . . . . 0.0 110.184 -176.878 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -62.47 -47.63 83.14 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.776 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.508 ' O ' ' HG2' ' A' ' 24' ' ' MET . 12.7 ptm180 -72.57 -32.34 65.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.563 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.632 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 36.4 tp -64.85 -50.28 67.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.152 -178.326 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -67.02 -29.92 69.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.272 0.558 . . . . 0.0 110.309 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 46.1 tt0 -67.69 -54.75 16.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.5 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 25.7 ptm -68.66 -34.63 76.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.068 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.632 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 12.3 tptm -56.69 -51.79 67.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.312 0.577 . . . . 0.0 110.308 178.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.48 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 41.2 tt0 -65.41 -36.33 83.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.647 -179.06 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.402 ' HE3' ' CE1' ' A' ' 58' ' ' TYR . 18.7 mtpp -62.94 -36.45 83.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.731 178.249 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 24' ' ' MET . 95.9 t -70.73 -38.55 73.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.178 0.513 . . . . 0.0 109.738 177.029 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 25.9 mmt -77.36 5.27 9.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.042 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 1.9 mptp? -101.53 -13.7 17.78 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.775 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.675 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 35.5 t70 -85.6 142.59 29.0 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.257 0.551 . . . . 0.0 111.927 -172.018 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -72.48 -44.2 62.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.463 -176.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -67.8 -38.56 83.46 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 -178.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.424 ' O ' HD23 ' A' ' 38' ' ' LEU . 46.2 t -53.71 -46.54 62.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.873 175.199 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.675 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 59.0 mm-40 -57.92 -52.36 65.8 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.048 0.451 . . . . 0.0 110.852 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.46 97.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.516 -176.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.1 t80 -63.71 -40.05 95.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.635 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.531 HD11 HD11 ' A' ' 50' ' ' ILE . 2.2 mm? -62.13 -49.32 76.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.371 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -66.71 -28.09 68.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.249 0.547 . . . . 0.0 110.804 -177.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.44 -33.33 54.82 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.563 -178.017 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -119.16 25.67 10.0 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.393 -175.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -70.0 -17.02 63.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.636 0.255 . . . . 0.0 111.616 -175.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -71.79 -39.89 69.58 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.1 t -93.41 -41.44 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.737 -172.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.493 HG12 ' SD ' ' A' ' 49' ' ' MET . 64.9 mt -92.92 141.74 14.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.029 -176.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.49 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -131.54 -179.21 5.23 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.12 -36.85 80.84 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.539 0.2 . . . . 0.0 111.539 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -62.27 -48.74 78.6 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.493 ' SD ' HG12 ' A' ' 45' ' ' ILE . 44.5 ttm -60.1 -35.97 76.38 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.774 178.007 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.531 HD11 HD11 ' A' ' 38' ' ' LEU . 36.6 mm -63.53 -47.8 89.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.056 178.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -70.37 -30.56 67.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.951 0.405 . . . . 0.0 110.766 -178.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.474 ' N ' ' HE3' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -75.49 -40.9 56.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.041 179.189 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.461 ' HB2' HD12 ' A' ' 94' ' ' ILE . 15.4 m -95.87 21.3 8.74 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.475 178.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.2 tp -59.13 -40.75 86.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.408 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -59.68 -41.55 90.94 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.363 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.515 ' O ' HD11 ' A' ' 96' ' ' ILE . 73.7 mmtt -64.01 -53.44 49.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.759 178.631 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.405 HD11 HG21 ' A' ' 94' ' ' ILE . 11.0 mp -61.06 -39.12 88.66 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.151 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.402 ' CE1' ' HE3' ' A' ' 27' ' ' LYS . 32.3 t80 -67.49 -40.95 85.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.774 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -64.49 -37.8 88.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.342 0.591 . . . . 0.0 109.9 177.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 54.9 t80 -65.33 -47.1 77.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.162 -177.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.552 ' HA ' ' HE3' ' A' ' 65' ' ' LYS . 23.7 pt -70.32 -30.51 43.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 C-N-CA 121.148 -0.221 . . . . 0.0 111.508 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -81.34 -25.19 36.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.795 -179.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 2.2 pt20 -82.51 156.0 24.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.693 -178.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 14.5 m -62.48 109.46 1.38 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.455 -177.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.552 ' HE3' ' HA ' ' A' ' 61' ' ' ILE . 93.7 mttt -83.26 -41.0 18.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.911 178.372 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -78.75 171.53 15.02 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.167 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -141.16 154.01 45.65 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -178.452 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.552 ' HB2' ' OE2' ' A' ' 81' ' ' GLU . 72.5 m -74.31 -11.45 60.27 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.507 0.504 . . . . 0.0 111.442 -170.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.21 -0.43 19.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.001 174.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 28.6 p -143.67 -28.19 0.53 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.761 176.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.496 ' O ' ' HA ' ' A' ' 68' ' ' SER . 16.5 m -114.16 151.19 33.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -100.31 7.36 44.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.585 0.231 . . . . 0.0 111.211 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.13 104.36 0.14 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.369 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -83.01 -23.92 33.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.821 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -92.73 29.68 1.72 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.492 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 31.1 p -134.4 126.62 29.93 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 174.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -83.38 120.89 26.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.302 0.572 . . . . 0.0 109.834 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -111.06 109.83 20.1 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.316 0.579 . . . . 0.0 109.879 174.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.5 tt -57.65 -61.41 2.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.108 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.2 mp -86.47 162.95 17.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.574 173.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.552 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 6.8 tp10 -141.07 145.57 36.01 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.93 6.92 87.51 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -169.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.659 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 78.5 m-85 -134.51 154.98 51.16 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.76 0.314 . . . . 0.0 110.881 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.404 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 18.8 m170 -130.48 146.07 60.18 Favored Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 174.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.462 ' CG ' ' HA ' ' A' ' 65' ' ' LYS . 69.7 Cg_endo -78.05 143.16 20.15 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.191 1.927 . . . . 0.0 111.82 174.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -144.15 150.74 38.54 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 176.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 97.5 mt -75.75 137.57 40.67 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.025 176.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.455 HG21 ' OE2' ' A' ' 97' ' ' GLU . 30.2 m -130.58 148.52 33.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 116.28 -0.418 . . . . 0.0 109.931 177.507 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.3 p -87.87 116.27 29.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.555 0.693 . . . . 0.0 109.551 175.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.31 95.88 5.28 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.098 -176.051 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.81 -108.31 2.33 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.849 -176.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -117.67 19.29 13.92 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.306 0.574 . . . . 0.0 109.985 177.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 11.6 p -132.48 160.49 36.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.003 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.461 HD12 ' HB2' ' A' ' 53' ' ' SER . 47.1 mt -104.67 134.65 45.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -125.49 178.14 5.8 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -175.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.515 HD11 ' O ' ' A' ' 56' ' ' LYS . 26.9 mt -130.83 113.71 25.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.882 -178.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.455 ' OE2' HG21 ' A' ' 88' ' ' VAL . 32.8 mt-10 -126.85 159.38 34.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.585 -0.279 . . . . 0.0 110.287 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.659 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 8.0 m-85 -99.31 136.08 39.78 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.981 0.42 . . . . 0.0 112.026 -175.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -115.19 158.62 22.01 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 173.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.91 139.37 43.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.749 0.309 . . . . 0.0 110.614 -175.451 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 33.0 t -55.07 121.82 38.42 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.117 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.61 -9.25 25.56 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.374 2.05 . . . . 0.0 112.576 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 33.4 t -82.01 -13.53 12.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.182 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.9 tptp -77.51 -26.94 51.61 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.85 -178.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -134.35 112.03 10.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.853 0.358 . . . . 0.0 110.153 -177.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.678 -179.492 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 tpt . . . . . 0 N--CA 1.477 0.888 0 CA-C-O 120.796 0.331 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -169.76 86.28 0.58 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.751 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.51 85.92 0.45 Allowed 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 122.243 1.962 . . . . 0.0 111.924 177.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.5 tt -136.25 133.6 49.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.236 0.541 . . . . 0.0 110.931 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -128.82 90.44 0.32 Allowed Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.006 -0.837 . . . . 0.0 111.006 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -75.87 126.89 31.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.001 0.429 . . . . 0.0 110.764 -174.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.1 m -85.13 78.79 9.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.932 -178.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 41.6 tp -81.57 73.52 8.61 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 175.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -161.32 155.19 22.16 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.358 -176.076 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -151.38 -169.8 17.47 Favored Glycine 0 N--CA 1.447 -0.612 0 N-CA-C 111.436 -0.666 . . . . 0.0 111.436 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.8 t -84.06 105.78 13.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.248 0.547 . . . . 0.0 109.904 -179.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 22.9 m -147.05 157.58 43.66 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.409 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -75.89 161.64 52.39 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.754 177.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.409 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.2 OUTLIER -141.96 84.24 12.01 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 -179.0 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.461 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 15.0 Cg_endo -58.46 132.67 49.92 Favored 'Trans proline' 0 C--O 1.233 0.234 0 C-N-CA 122.927 2.418 . . . . 0.0 111.522 175.39 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.945 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 9.9 t70 -69.73 -24.9 63.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.639 -176.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -53.26 -55.97 20.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.485 178.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.565 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 2.3 pt20 -66.17 -31.22 71.94 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.739 0.304 . . . . 0.0 110.761 -177.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.945 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 50.4 mtpt -58.27 -42.12 85.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.388 177.713 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.707 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 23.2 mtp180 -78.8 -41.36 30.54 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.902 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.565 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 30.1 tp -54.27 -49.75 68.85 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.737 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -75.92 -28.52 58.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.018 0.437 . . . . 0.0 110.759 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.484 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 43.2 tt0 -62.41 -55.27 29.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.913 176.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.472 ' O ' HG23 ' A' ' 28' ' ' VAL . 27.1 ptm -62.99 -35.86 81.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.755 -179.194 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.672 ' O ' ' HG2' ' A' ' 29' ' ' MET . 4.1 tppp? -55.82 -53.86 51.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 173.119 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.63 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 2.3 tt0 -55.07 -48.16 73.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.651 178.136 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.442 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 12.5 mmmt -51.84 -42.23 62.43 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.064 178.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.564 ' HA ' HD13 ' A' ' 61' ' ' ILE . 78.6 t -69.89 -37.61 73.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 121.212 0.53 . . . . 0.0 110.3 -177.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.672 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 29.1 mmm -75.23 5.82 5.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.557 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.63 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 30.5 mmtp -102.81 -18.27 15.19 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.657 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 23.1 t70 -81.27 129.28 34.54 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.731 -0.388 . . . . 0.0 111.142 -175.401 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -62.66 -36.58 83.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.826 -0.624 . . . . 0.0 112.2 -175.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -73.74 -36.75 65.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.834 0.35 . . . . 0.0 110.402 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 32.8 t -57.72 -50.09 78.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.406 173.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 45.8 mt-30 -61.32 -41.29 96.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.577 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.433 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -58.86 -40.84 85.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.67 177.033 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -67.79 -41.39 83.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.765 177.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.485 HD11 HD11 ' A' ' 50' ' ' ILE . 1.9 mm? -60.75 -45.37 94.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.366 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -72.87 -25.1 60.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.01 0.433 . . . . 0.0 110.797 -178.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -78.85 -32.13 45.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.683 -177.512 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -122.73 28.33 7.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.278 -178.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -62.84 -23.86 67.5 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.935 0.398 . . . . 0.0 111.43 -178.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -70.79 -32.95 70.22 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.289 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.9 t -94.74 -44.53 13.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.926 -172.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.6 mt -79.8 142.87 13.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.328 -174.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -127.95 176.3 7.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.423 175.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.561 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 49.1 mt-30 -58.77 -46.4 87.57 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -177.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -60.01 -40.0 87.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.756 0.312 . . . . 0.0 111.297 -178.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.486 ' HG2' HG13 ' A' ' 94' ' ' ILE . 44.1 ttm -60.06 -43.39 95.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.476 177.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.485 HD11 HD11 ' A' ' 38' ' ' LEU . 38.2 mm -62.79 -44.71 99.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.061 178.531 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 13.7 mm-40 -61.89 -36.42 81.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.595 -177.214 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.9 mtmt -75.31 -44.17 46.92 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.793 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.495 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 26.0 m -91.93 19.65 6.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.588 -174.316 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 45.9 tp -62.47 -37.9 87.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.853 0.358 . . . . 0.0 110.317 178.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -62.18 -39.99 94.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.352 176.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.571 ' O ' HD11 ' A' ' 96' ' ' ILE . 70.2 mmtt -61.53 -53.32 57.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.1 0.476 . . . . 0.0 110.885 178.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.16 -36.58 84.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.354 -177.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -69.58 -42.42 74.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.796 0.331 . . . . 0.0 110.157 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -56.18 -42.8 77.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.965 175.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.419 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 76.2 t80 -61.52 -46.97 87.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.418 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.564 HD13 ' HA ' ' A' ' 28' ' ' VAL . 36.2 pt -75.38 -31.14 23.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 -175.226 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -84.1 -19.33 34.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.762 0.315 . . . . 0.0 111.078 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -88.08 -178.05 5.88 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 173.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.0 m -71.75 124.62 25.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.118 0.485 . . . . 0.0 111.345 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -78.17 -27.09 47.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.922 174.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.555 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 79.0 m-20 -99.92 -164.6 1.14 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.005 175.326 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.7 p -146.18 156.77 43.64 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 176.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 t -66.0 -13.34 59.69 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.212 0.529 . . . . 0.0 111.12 -173.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -78.49 -3.4 43.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.733 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.4 p -134.77 -38.92 0.8 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.235 176.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.1 p -83.39 130.55 35.05 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 177.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.423 ' H ' ' HG2' ' A' ' 72' ' ' GLU . 7.2 pt-20 -95.98 0.58 51.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.25 0.548 . . . . 0.0 110.989 -176.039 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -75.31 104.22 5.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.374 171.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.92 5.85 20.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.772 -175.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -70.45 -40.18 73.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.913 0.387 . . . . 0.0 110.378 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 72.5 m -86.96 113.62 22.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.593 176.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -105.42 144.58 32.0 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 173.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.678 ' HB3' ' HG ' ' A' ' 80' ' ' LEU . 22.2 m120 -142.13 158.21 44.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.16 -175.186 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.43 -22.14 55.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.367 0.603 . . . . 0.0 109.399 171.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.678 ' HG ' ' HB3' ' A' ' 78' ' ' ASN . 2.6 pp -82.42 126.24 31.98 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.259 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -143.55 118.01 9.7 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.961 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.27 -8.18 68.8 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.844 -176.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.436 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 89.8 m-85 -126.28 162.19 26.04 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.555 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 16.1 m170 -125.92 148.54 63.04 Favored Pre-proline 0 CA--C 1.514 -0.416 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.31 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.419 ' O ' ' HE1' ' A' ' 60' ' ' TYR . 42.2 Cg_endo -69.81 144.27 53.24 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.226 1.951 . . . . 0.0 111.593 175.618 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.478 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 59.9 tttp -146.75 134.15 20.75 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.25 -178.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.408 HD22 ' H ' ' A' ' 87' ' ' LEU . 2.0 mm? -71.74 131.54 43.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 178.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.401 HG21 ' HG2' ' A' ' 97' ' ' GLU . 35.1 m -129.13 152.15 36.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.131 177.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -99.15 112.1 30.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.366 0.603 . . . . 0.0 109.55 173.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -110.19 96.82 6.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.819 -178.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.36 -99.87 0.68 Allowed Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.527 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -118.63 3.41 11.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.665 0.269 . . . . 0.0 111.405 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.4 t -124.35 150.69 45.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.784 0.326 . . . . 0.0 110.826 -176.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.495 ' HB ' ' CB ' ' A' ' 53' ' ' SER . 66.5 mt -94.33 139.13 19.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 176.041 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -135.57 178.39 7.08 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -175.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.571 HD11 ' O ' ' A' ' 56' ' ' LYS . 65.6 mt -121.16 101.34 10.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.616 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.401 ' HG2' HG21 ' A' ' 88' ' ' VAL . 35.4 mm-40 -95.97 -170.46 2.13 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.672 176.077 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.435 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 43.7 m-85 -133.65 141.89 47.81 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.281 0.562 . . . . 0.0 111.71 -175.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.478 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 46.0 p90 -122.26 151.39 41.13 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.213 172.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.436 ' HG2' ' CE1' ' A' ' 83' ' ' TYR . 41.5 mt-10 -65.77 127.76 33.27 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.193 -177.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.47 ' SG ' HG12 ' A' ' 103' ' ' VAL . 49.8 t -48.34 123.31 10.76 Favored Pre-proline 0 N--CA 1.463 0.219 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.482 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -67.83 5.57 1.02 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 123.266 2.644 . . . . 0.0 113.886 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.47 HG12 ' SG ' ' A' ' 101' ' ' CYS . 5.9 p -86.33 -19.54 8.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 O-C-N 122.1 -0.375 . . . . 0.0 110.464 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -67.98 -51.63 45.13 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.298 -176.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -136.05 30.26 3.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.185 -178.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.7 mttm . . . . . 0 C--O 1.236 0.363 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.144 -178.545 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.9 mmm . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.896 0.379 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.507 ' OE1' ' HD2' ' A' ' 6' ' ' ARG . 26.7 mt-10 -138.91 153.07 71.52 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.682 -178.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -75.34 177.46 8.62 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.667 2.244 . . . . 0.0 112.998 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.489 HD13 ' O ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -78.3 4.09 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 121.881 0.848 . . . . 0.0 110.287 -177.107 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.76 -20.31 59.48 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.209 177.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.507 ' HD2' ' OE1' ' A' ' 2' ' ' GLU . 20.8 mtp180 -75.3 79.03 2.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.806 0.336 . . . . 0.0 110.163 175.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.5 m -84.97 93.99 8.69 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.178 0.513 . . . . 0.0 110.724 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 48.6 tp -68.68 -26.95 65.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.934 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -87.76 14.88 7.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.105 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.55 -14.95 80.72 Favored Glycine 0 N--CA 1.451 -0.36 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.455 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.1 t -83.17 97.83 4.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 176.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 p -68.55 -58.19 4.66 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.759 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -148.9 126.99 2.38 Favored Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.376 -0.916 . . . . 0.0 112.664 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.45 ' HA ' ' HD2' ' A' ' 15' ' ' PRO . 17.8 ttt180 -154.89 85.8 3.55 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 175.23 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.45 ' HD2' ' HA ' ' A' ' 14' ' ' ARG . 8.5 Cg_endo -48.74 137.09 27.38 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 124.141 3.227 . . . . 0.0 113.646 -174.123 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.576 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 6.3 p-10 -63.71 -21.37 66.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.624 178.502 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -53.61 -58.62 6.52 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.702 175.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -71.87 -30.8 65.8 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.768 -178.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.576 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 52.9 mtmt -64.08 -45.55 88.21 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.066 -0.254 . . . . 0.0 110.672 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -71.87 -37.54 70.17 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 178.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.4 tp -63.19 -49.92 72.36 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.946 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.403 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 75.2 mm-40 -65.95 -35.81 81.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.524 177.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -62.52 -59.11 5.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.161 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.43 ' O ' HG23 ' A' ' 28' ' ' VAL . 22.7 ptm -61.63 -40.49 95.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.938 -177.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.42 ' O ' ' HG2' ' A' ' 29' ' ' MET . 55.3 tptt -62.0 -43.19 99.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.959 0.409 . . . . 0.0 109.978 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.423 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 3.2 tp10 -60.53 -46.54 89.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.579 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -64.5 -41.81 96.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.171 -176.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 24' ' ' MET . 71.5 t -70.98 -44.51 75.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.082 -175.077 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.466 ' C ' ' HD3' ' A' ' 30' ' ' LYS . 90.6 mmm -71.07 -15.24 62.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.865 0.364 . . . . 0.0 110.805 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HD3' ' C ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -110.48 13.65 22.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.716 -178.761 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.567 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 26.5 t70 -85.41 131.74 34.34 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 170.429 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -61.31 -38.14 85.77 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.419 0.449 . . . . 0.0 111.845 -174.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -71.38 -47.22 57.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.168 0.509 . . . . 0.0 109.669 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.6 t -55.06 -55.13 17.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.496 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.596 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.3 pt20 -65.78 -27.73 68.5 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.529 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.433 ' HA ' ' NZ ' ' A' ' 39' ' ' LYS . . . -62.79 -45.66 91.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.309 0.576 . . . . 0.0 109.739 173.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -66.81 -40.78 88.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.711 176.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.666 HD11 HD11 ' A' ' 50' ' ' ILE . 1.6 mm? -58.99 -48.88 79.97 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.949 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' A' ' 35' ' ' GLN . 17.9 pttm -73.55 -24.0 60.06 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.015 -178.021 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.43 -41.26 76.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.118 0.485 . . . . 0.0 110.229 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -115.41 28.99 8.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.526 -174.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -69.2 -14.9 63.24 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.149 0.5 . . . . 0.0 110.62 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.54 -31.22 71.17 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.677 0.751 . . . . 0.0 109.625 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.1 t -106.05 -41.77 6.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.512 -172.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.9 mt -87.32 141.71 13.97 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.761 -171.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.403 ' O ' HG12 ' A' ' 50' ' ' ILE . 5.5 p-10 -124.26 178.07 5.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.361 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.463 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 77.3 mt-30 -58.88 -46.05 88.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.635 0.255 . . . . 0.0 111.156 -178.278 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 27.2 mmtm -68.54 -35.41 77.41 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -174.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 51.9 ttm -59.51 -32.06 69.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 171.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.666 HD11 HD11 ' A' ' 38' ' ' LEU . 42.3 mm -72.18 -46.59 57.56 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.594 177.027 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 1.7 mp0 -58.13 -46.02 86.35 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 120.97 0.414 . . . . 0.0 111.016 175.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 50.3 tptt -58.82 -40.28 83.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.821 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -104.22 17.83 23.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.981 -175.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.7 OUTLIER -60.02 -43.38 95.31 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.138 0.494 . . . . 0.0 110.114 -177.868 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -57.58 -40.1 78.23 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.182 176.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.599 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 6.9 mmpt? -71.46 -48.19 50.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.633 0.254 . . . . 0.0 111.272 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.503 HD21 HG21 ' A' ' 94' ' ' ILE . 95.1 mt -61.26 -39.71 91.36 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.103 0.478 . . . . 0.0 110.593 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -68.07 -40.12 82.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.243 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.73 -37.04 77.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.24 176.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -66.35 -43.68 85.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.907 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 pt -75.2 -29.92 22.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 120.713 -0.395 . . . . 0.0 112.037 -174.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -80.93 -27.05 36.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.699 0.285 . . . . 0.0 111.329 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -80.44 -176.96 5.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.928 0.394 . . . . 0.0 110.693 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.1 m -79.09 124.14 28.01 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.165 -176.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -77.67 -27.1 50.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.345 0.593 . . . . 0.0 109.99 171.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -97.97 -167.04 1.46 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.437 178.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -153.53 155.19 35.74 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.049 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.3 m -72.04 -20.08 61.74 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.301 -171.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -63.19 -21.09 65.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.167 177.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 16.3 p -115.45 -54.48 2.53 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.515 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -91.65 -179.16 5.27 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.016 -175.001 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.57 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 0.8 OUTLIER -93.76 24.67 3.99 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.607 -177.59 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -60.56 108.78 0.88 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.333 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -69.6 -15.28 63.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.128 0.489 . . . . 0.0 110.163 178.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -73.54 68.14 1.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.293 0.568 . . . . 0.0 109.865 174.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 40.8 m -85.13 17.32 3.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.802 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -92.1 12.84 20.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.229 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.657 ' HB2' ' HG2' ' A' ' 81' ' ' GLU . 77.0 m-20 -62.23 110.49 1.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 172.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.548 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.2 pt? -56.19 -50.99 69.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.123 -178.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.448 HD22 ' HG ' ' A' ' 79' ' ' LEU . 3.9 mm? -88.02 62.15 6.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.509 0.195 . . . . 0.0 111.0 173.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.657 ' HG2' ' HB2' ' A' ' 78' ' ' ASN . 1.6 mm-40 -72.8 159.75 33.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.959 0.409 . . . . 0.0 110.113 177.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 79.95 -8.66 49.68 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.038 -174.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.431 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 35.0 m-85 -122.17 172.57 8.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.0 m170 -129.76 144.41 52.89 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 171.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.06 135.5 19.05 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.428 2.085 . . . . 0.0 112.328 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -136.6 133.58 36.48 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 93.8 mt -71.44 138.38 49.01 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.183 -176.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.439 HG21 ' HG3' ' A' ' 97' ' ' GLU . 30.7 m -134.33 149.92 30.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.821 177.117 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.6 p -103.58 117.91 49.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-O 121.089 0.471 . . . . 0.0 109.983 174.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -117.97 93.92 4.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.765 -177.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 58.62 -87.96 0.02 OUTLIER Glycine 0 CA--C 1.521 0.409 0 CA-C-N 115.463 -0.79 . . . . 0.0 114.461 175.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.832 ' HD3' ' H ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -99.07 -15.19 19.11 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -170.292 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.6 p -148.6 170.73 17.46 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.224 0.535 . . . . 0.0 111.569 -173.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.503 HG21 HD21 ' A' ' 57' ' ' LEU . 59.4 mt -106.78 136.49 41.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.377 -179.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -130.06 179.2 6.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.899 0.38 . . . . 0.0 110.732 -173.388 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 57.9 mt -127.22 114.11 35.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.259 -178.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.439 ' HG3' HG21 ' A' ' 88' ' ' VAL . 31.6 mt-10 -114.39 153.19 30.29 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.164 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.431 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 38.2 m-85 -105.68 130.39 53.71 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.123 0.487 . . . . 0.0 111.923 -173.087 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.3 p90 -106.67 149.66 27.03 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 171.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -69.75 139.79 53.35 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.214 -0.594 . . . . 0.0 110.701 -174.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.568 ' SG ' HG12 ' A' ' 103' ' ' VAL . 49.2 t -48.07 123.69 10.38 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.241 177.144 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.96 -14.02 40.82 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.306 2.671 . . . . 0.0 113.887 -172.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.568 HG12 ' SG ' ' A' ' 101' ' ' CYS . 8.4 p -67.81 -25.17 31.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.977 0.418 . . . . 0.0 110.408 178.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -75.74 -47.39 26.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.679 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -101.24 90.49 4.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.274 -174.626 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.9 mttp . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.518 -179.745 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.419 ' CG ' ' HD2' ' A' ' 3' ' ' PRO . 26.4 tt0 -112.97 144.15 30.51 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.419 ' HD2' ' CG ' ' A' ' 2' ' ' GLU . 5.9 Cg_endo -48.3 116.62 2.11 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.063 2.509 . . . . 0.0 112.285 177.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.429 ' H ' HD12 ' A' ' 4' ' ' ILE . 4.8 mp -84.69 -29.9 6.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.495 178.121 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.82 -128.48 8.62 Favored Glycine 0 N--CA 1.444 -0.821 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.254 -177.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.475 ' HB2' ' HG ' ' A' ' 8' ' ' LEU . 9.5 ptt180 -144.84 136.91 25.94 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.958 0.409 . . . . 0.0 110.692 178.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.4 m -90.74 19.09 5.73 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.701 -172.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.475 ' HG ' ' HB2' ' A' ' 6' ' ' ARG . 1.6 pp -86.09 25.94 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.202 0.525 . . . . 0.0 110.788 177.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -111.95 128.09 56.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.718 -174.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.54 -64.05 4.34 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 113.968 172.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 t -70.11 94.71 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.127 0.489 . . . . 0.0 111.792 -172.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.8 p -98.94 16.49 22.29 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.498 0.665 . . . . 0.0 110.411 175.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -79.2 75.37 2.08 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.483 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -142.65 62.97 13.47 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 178.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.607 ' HD2' ' HG2' ' A' ' 18' ' ' GLN . 41.8 Cg_endo -68.82 159.57 53.23 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 121.721 1.614 . . . . 0.0 110.816 172.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -65.38 -19.44 65.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.024 0.44 . . . . 0.0 110.217 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.535 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 81.3 t80 -63.52 -51.79 63.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.839 175.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.607 ' HG2' ' HD2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -71.17 -31.84 68.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -177.514 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -64.14 -48.86 74.38 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.702 177.303 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 17' ' ' PHE . 6.1 ptp180 -64.89 -31.41 72.63 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.8 tp -68.67 -49.37 59.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.254 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.5 -35.81 81.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.937 0.399 . . . . 0.0 110.03 176.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -60.98 -55.48 32.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.265 179.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.411 ' O ' HG23 ' A' ' 28' ' ' VAL . 24.8 ptm -65.27 -38.34 89.99 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.153 -179.182 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.5 tptm -63.56 -41.71 98.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.155 0.503 . . . . 0.0 110.013 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.476 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 15.2 tm-20 -58.34 -47.11 84.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.954 177.692 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -58.63 -55.23 37.77 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.706 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 24' ' ' MET . 96.3 t -62.65 -42.21 95.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.949 0.404 . . . . 0.0 111.167 -174.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.5 mmt -77.51 -5.62 50.67 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -174.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HE3' ' O ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -127.24 6.51 6.43 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.306 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.588 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 0.8 OUTLIER -84.23 136.91 33.76 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.343 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -60.09 -49.18 78.67 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.325 -169.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -65.24 -35.79 82.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.153 0.502 . . . . 0.0 110.669 -174.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 99.5 t -62.21 -37.82 79.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.095 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.588 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 70.8 mm-40 -58.73 -44.69 90.54 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.321 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.99 -48.17 82.53 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.107 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -62.23 -41.83 98.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.514 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 38' ' ' LEU . 2.7 mm? -59.8 -42.21 92.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.802 -178.215 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -82.42 -21.79 35.58 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.881 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -62.3 -50.89 69.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.556 0.693 . . . . 0.0 110.067 175.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -112.83 36.03 3.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.586 -177.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 43' ' ' GLU . 7.3 pt-20 -52.15 -40.54 61.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.464 -175.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.442 ' N ' ' HG3' ' A' ' 42' ' ' GLU . 15.2 tp10 -85.49 -13.17 49.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.078 0.466 . . . . 0.0 111.058 -173.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.3 t -99.07 -38.25 6.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.112 0.482 . . . . 0.0 110.754 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.8 mt -83.13 150.18 4.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.648 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -124.23 165.52 17.48 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 173.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -60.43 -40.06 89.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.073 0.463 . . . . 0.0 111.502 -175.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.466 ' HD3' ' HA ' ' A' ' 48' ' ' LYS . 68.1 mmtt -73.03 -31.85 64.71 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.579 -178.199 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 54.4 ttm -54.41 -43.77 71.78 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.897 0.379 . . . . 0.0 110.193 171.09 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.11 -44.19 94.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.751 178.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.528 ' HA ' ' HB2' ' A' ' 54' ' ' LEU . 41.2 mt-10 -70.97 -38.45 72.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.759 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -66.57 -23.98 66.28 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.034 0.445 . . . . 0.0 111.372 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.4 m -120.54 25.68 9.62 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.25 176.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.528 ' HB2' ' HA ' ' A' ' 51' ' ' GLU . 51.4 tp -61.58 -34.28 75.32 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.423 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -67.34 -33.49 75.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.031 176.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.439 ' O ' HD11 ' A' ' 96' ' ' ILE . 54.4 mmtt -74.6 -43.77 53.95 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.511 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.84 -37.9 80.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.954 0.407 . . . . 0.0 109.989 175.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -74.98 -39.21 61.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.337 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.452 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 40.8 tt0 -63.25 -32.06 73.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.304 0.573 . . . . 0.0 109.858 176.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.487 ' HE1' ' C ' ' A' ' 85' ' ' PRO . 69.0 t80 -63.76 -54.88 28.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.408 178.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 21.5 pt -65.51 -28.91 45.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.936 -174.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.452 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 9.4 pt-20 -78.23 -37.03 46.25 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.044 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -86.33 113.49 22.36 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.693 0.282 . . . . 0.0 111.67 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.483 ' HB2' ' HD3' ' A' ' 85' ' ' PRO . 11.5 m 53.55 62.13 2.79 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.597 173.22 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -63.49 -27.13 69.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 122.177 0.989 . . . . 0.0 108.777 173.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.3 p30 -138.52 -157.28 0.76 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.272 -1.331 . . . . 0.0 108.188 173.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.6 p -151.25 153.41 34.82 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 170.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 t -65.1 -29.87 70.77 Favored 'General case' 0 C--N 1.313 -1.014 0 O-C-N 123.782 0.677 . . . . 0.0 110.373 -170.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -55.79 -36.12 67.05 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.978 178.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.2 p -103.72 -6.71 21.26 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.57 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -105.27 168.44 9.07 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -95.05 -13.01 25.56 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -76.0 114.73 14.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.343 178.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -87.41 -22.55 24.94 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 175.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -75.84 75.76 2.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.897 178.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 38.4 t -163.55 133.91 4.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.766 178.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -116.29 77.78 1.13 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.029 0.442 . . . . 0.0 111.036 -175.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -72.25 136.58 46.37 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.358 172.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 46.9 tp -62.84 -67.45 0.42 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.476 ' HB3' ' CD2' ' A' ' 83' ' ' TYR . 6.0 mp -88.08 90.71 8.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.742 170.051 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -83.0 144.84 29.68 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.86 -7.8 78.82 Favored Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -169.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.476 ' CD2' ' HB3' ' A' ' 80' ' ' LEU . 46.1 m-85 -126.07 164.05 21.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.578 -0.311 . . . . 0.0 110.334 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -128.51 154.23 79.4 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 169.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.564 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 71.8 Cg_endo -80.14 165.79 21.2 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.467 2.111 . . . . 0.0 112.167 177.214 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -152.69 147.22 25.85 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 173.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 60' ' ' TYR . 2.5 mm? -78.52 140.6 38.54 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.447 177.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.9 m -137.81 141.05 39.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.579 173.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.5 p -89.17 129.69 39.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.171 0.51 . . . . 0.0 111.168 -178.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -132.3 96.08 3.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.736 175.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.52 -113.8 4.6 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.753 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.471 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 29.4 mmt180 -111.61 14.09 21.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.113 0.483 . . . . 0.0 110.321 177.486 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 48.3 t -123.98 148.05 47.27 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.276 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 89.4 mt -110.63 125.94 67.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.032 178.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -109.68 174.78 5.71 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.881 -175.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.439 HD11 ' O ' ' A' ' 56' ' ' LYS . 58.0 mt -126.38 105.74 14.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.625 -176.6 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.564 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 17.4 mm-40 -95.93 -173.88 2.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.877 178.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -135.61 143.77 45.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.037 0.446 . . . . 0.0 111.098 179.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -129.71 155.95 45.07 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 173.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -71.79 137.47 47.66 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.831 0.348 . . . . 0.0 110.598 -178.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.561 ' SG ' HG12 ' A' ' 103' ' ' VAL . 43.9 t -55.82 122.83 48.96 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.108 178.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -71.02 -7.77 22.15 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.956 2.437 . . . . 0.0 113.536 -175.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.561 HG12 ' SG ' ' A' ' 101' ' ' CYS . 3.8 p -69.67 -19.67 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.009 0.433 . . . . 0.0 110.429 178.322 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -65.78 -25.33 67.21 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 45.9 mmm-85 -97.25 86.54 3.94 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.57 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.312 -1.026 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.651 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.48 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 24.9 mmt . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -114.94 87.53 15.3 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.963 -176.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.48 ' HD3' ' O ' ' A' ' 1' ' ' MET . 4.4 Cg_exo -73.78 78.19 2.51 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.538 2.159 . . . . 0.0 111.229 175.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 59.3 mt -90.02 -52.54 10.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.084 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -135.58 88.0 0.24 Allowed Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.016 -176.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.446 ' O ' ' HG3' ' A' ' 6' ' ' ARG . 11.6 ptp180 -77.07 101.61 6.15 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 173.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 p -111.87 29.3 7.99 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.688 -173.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 92.7 mt -78.05 -30.23 49.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.288 0.566 . . . . 0.0 110.259 178.162 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -104.46 112.44 25.5 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.155 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.92 -167.11 41.66 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.822 176.059 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.7 t -81.68 92.6 2.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.204 0.526 . . . . 0.0 109.867 178.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.5 p -104.74 88.71 2.98 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.057 176.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.578 ' C ' ' HD2' ' A' ' 14' ' ' ARG . . . 80.81 -167.46 50.03 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.637 -176.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.578 ' HD2' ' C ' ' A' ' 13' ' ' GLY . 7.6 mpt_? -141.65 76.22 20.78 Favored Pre-proline 0 C--N 1.324 -0.528 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.531 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 71.9 Cg_endo -76.01 64.13 6.88 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.74 2.293 . . . . 0.0 112.367 176.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.621 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -66.92 -29.06 68.84 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.951 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -59.14 -50.0 75.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.83 0.348 . . . . 0.0 110.063 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.531 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 4.1 pp0? -71.07 -29.25 65.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.161 -179.096 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -63.24 -49.07 75.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.405 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.621 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 20.5 mtm105 -69.03 -40.76 78.44 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 121.456 0.646 . . . . 0.0 109.449 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 34.1 tp -54.54 -49.29 70.64 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.491 -1.231 . . . . 0.0 111.212 177.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -75.45 -28.32 59.25 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.638 177.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.414 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 55.8 tp60 -62.0 -52.64 63.18 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.273 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.611 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.2 ptm -66.3 -36.43 82.94 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.407 177.325 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -55.3 -50.0 70.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.942 0.401 . . . . 0.0 110.487 175.276 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -58.04 -47.04 84.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.503 178.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.42 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 25.9 mtpp -59.8 -42.67 93.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.811 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.612 HG12 HG11 ' A' ' 34' ' ' VAL . 84.5 t -67.81 -36.48 75.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.076 -176.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.4 ptp -82.65 -0.92 49.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.179 0.514 . . . . 0.0 110.387 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.5 tptt -91.61 -12.17 35.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.294 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 24.9 t70 -85.48 136.97 33.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.193 -176.545 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.96 -47.03 75.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.652 -177.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -63.52 -45.37 90.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.036 0.446 . . . . 0.0 110.444 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.612 HG11 HG12 ' A' ' 28' ' ' VAL . 49.7 t -56.41 -56.4 13.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.824 -179.046 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.521 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.2 pt20 -66.13 -29.95 70.35 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -176.587 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.62 -40.75 97.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.016 0.436 . . . . 0.0 109.932 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.468 ' CE2' HD11 ' A' ' 45' ' ' ILE . 93.1 t80 -70.23 -36.34 74.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.95 177.487 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.4 mm? -56.84 -49.46 75.37 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.412 178.03 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.521 ' HG2' ' O ' ' A' ' 35' ' ' GLN . 5.2 ptpp? -77.7 -21.33 52.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.237 0.542 . . . . 0.0 110.624 -178.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.81 -60.72 2.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.327 174.496 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -102.48 33.85 3.0 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.737 -174.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -61.62 -20.64 63.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.417 178.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -85.89 -16.06 39.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.807 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 41.3 t -109.94 -42.46 5.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.854 0.359 . . . . 0.0 111.591 -173.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.468 HD11 ' CE2' ' A' ' 37' ' ' PHE . 56.3 mt -78.43 144.0 11.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.668 -175.024 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -106.73 165.39 11.34 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.739 175.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -58.04 -45.15 87.45 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.925 0.393 . . . . 0.0 111.023 176.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.595 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 14.1 mmmm -67.01 -37.35 84.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.708 0.766 . . . . 0.0 110.323 -178.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.435 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 19.1 ttt -57.2 -37.61 72.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.296 176.091 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 28.3 mm -63.73 -54.61 29.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.404 178.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.595 ' OE2' ' HE2' ' A' ' 48' ' ' LYS . 2.0 pp20? -63.1 -43.88 97.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.086 0.469 . . . . 0.0 111.414 -178.155 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.56 ' HE2' ' HA ' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -57.3 -31.91 66.12 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.839 178.124 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 73.3 p -108.92 14.26 24.26 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.457 -178.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.8 tp -59.05 -34.45 71.95 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.928 0.394 . . . . 0.0 110.645 -179.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -66.91 -38.25 85.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.754 176.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.485 ' O ' HD11 ' A' ' 96' ' ' ILE . 27.8 mmmt -66.04 -47.97 72.6 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.058 0.456 . . . . 0.0 109.944 176.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.792 ' HG ' HD21 ' A' ' 87' ' ' LEU . 11.0 mp -64.64 -35.88 82.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.308 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -69.34 -43.05 74.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.73 0.3 . . . . 0.0 110.247 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.502 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 9.2 tp10 -58.66 -37.19 75.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.815 0.817 . . . . 0.0 109.801 174.638 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.493 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 87.9 t80 -61.83 -47.85 83.2 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.581 -1.19 . . . . 0.0 111.689 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.548 HD13 ' HA ' ' A' ' 28' ' ' VAL . 29.8 pt -76.36 -30.54 19.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -177.547 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.502 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 10.1 pt-20 -79.85 -20.09 46.82 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.466 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 10.1 pt20 -82.29 175.8 9.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.862 0.363 . . . . 0.0 110.206 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.1 m -68.35 102.88 1.49 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.102 0.477 . . . . 0.0 110.963 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -69.62 -31.15 69.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.282 177.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -93.76 -165.77 1.38 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.049 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -157.58 162.66 38.77 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.042 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.516 ' HA ' ' O ' ' A' ' 71' ' ' SER . 8.0 p -69.32 -18.93 63.87 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 123.48 0.487 . . . . 0.0 111.908 -174.471 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -77.83 4.98 10.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.109 0.48 . . . . 0.0 110.946 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 26.1 p -145.51 -44.51 0.21 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.712 175.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' A' ' 68' ' ' SER . 2.5 m -105.32 125.37 50.91 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.215 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -87.44 11.02 15.66 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.011 0.434 . . . . 0.0 111.232 -177.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.65 115.16 3.42 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.924 177.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -86.52 -5.3 59.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.679 176.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -60.95 -47.58 85.8 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.9 -177.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 19.0 p -101.28 143.73 30.99 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.8 -176.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -94.95 104.55 16.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.06 0.457 . . . . 0.0 110.238 176.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -81.33 103.34 11.03 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 174.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.6 tp -52.53 -61.95 1.95 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.727 -177.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.612 ' HB3' ' HB2' ' A' ' 83' ' ' TYR . 4.5 mm? -84.89 87.38 7.34 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.141 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.28 128.52 36.52 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.561 0.696 . . . . 0.0 110.785 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.25 -9.66 65.2 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.354 -175.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.612 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . 37.0 m-85 -117.39 168.39 10.4 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 122.473 0.309 . . . . 0.0 110.517 178.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.423 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 12.2 m170 -131.83 148.22 69.05 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.543 172.321 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -76.63 136.73 17.49 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.211 1.94 . . . . 0.0 111.577 176.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.473 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 40.3 ttpt -136.86 135.72 38.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.08 0.467 . . . . 0.0 110.191 177.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.792 HD21 ' HG ' ' A' ' 57' ' ' LEU . 1.0 OUTLIER -67.65 130.42 42.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.369 177.945 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.5 m -130.51 148.62 33.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 120.939 0.4 . . . . 0.0 110.88 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.7 p -97.64 115.08 36.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 173.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -117.89 96.17 5.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.447 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 63.56 -100.61 0.38 Allowed Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.481 -0.782 . . . . 0.0 112.827 177.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -112.18 15.16 20.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.144 0.497 . . . . 0.0 111.758 -176.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.1 p -143.85 149.02 36.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.681 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 62.6 mt -98.78 132.66 43.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 174.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -132.9 178.3 6.98 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.051 0.453 . . . . 0.0 110.699 -171.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.485 HD11 ' O ' ' A' ' 56' ' ' LYS . 40.7 mt -119.62 113.96 42.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.329 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -105.23 178.52 4.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.163 176.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.528 ' CE1' ' HB2' ' A' ' 80' ' ' LEU . 16.3 m-85 -127.59 129.16 46.8 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.636 179.131 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.473 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 54.0 p90 -113.17 150.78 31.76 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 174.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -65.21 129.96 41.61 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.403 -178.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 36.1 t -45.19 122.5 5.11 Favored Pre-proline 0 N--CA 1.463 0.21 0 O-C-N 123.409 0.443 . . . . 0.0 109.81 173.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.47 -30.09 86.95 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.856 2.371 . . . . 0.0 111.867 -177.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 16.9 t -66.63 -25.35 34.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.355 -178.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -61.49 -33.35 73.64 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.465 -174.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.18 13.49 3.89 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.751 177.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 95.3 mttt . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 114.756 -1.111 . . . . 0.0 112.441 177.317 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.613 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 1.3 mpt? . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.987 0.422 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.441 ' H ' ' CD ' ' A' ' 2' ' ' GLU . 0.2 OUTLIER -107.47 88.91 4.47 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.807 -177.037 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.613 ' HD3' ' O ' ' A' ' 1' ' ' MET . 2.9 Cg_exo -73.96 65.0 5.08 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.935 2.423 . . . . 0.0 112.765 -175.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 61.8 mt -94.37 100.74 11.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -120.46 101.18 0.8 Allowed Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.132 -173.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 6' ' ' ARG . 25.5 mtp85 -96.0 34.22 1.58 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.0 0.428 . . . . 0.0 109.955 172.666 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.2 p -63.76 107.58 1.23 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.964 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 87.9 mt -95.1 6.09 50.02 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.108 179.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -114.36 120.23 39.64 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.608 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.13 165.49 43.35 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.173 179.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.515 HG13 ' HD2' ' A' ' 15' ' ' PRO . 46.4 t -84.45 93.87 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.052 0.454 . . . . 0.0 110.269 178.107 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 m -87.88 104.2 16.38 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.393 177.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.489 ' O ' ' HD2' ' A' ' 14' ' ' ARG . . . 74.71 -118.32 5.71 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -173.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.489 ' HD2' ' O ' ' A' ' 13' ' ' GLY . 16.3 mmm180 -143.08 76.37 16.7 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-O 120.898 0.38 . . . . 0.0 110.683 175.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.515 ' HD2' HG13 ' A' ' 11' ' ' VAL . 72.8 Cg_endo -78.79 62.94 8.53 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.388 2.059 . . . . 0.0 111.521 173.455 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -72.51 -23.67 61.05 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.526 -178.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -64.46 -48.26 75.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.67 178.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -70.71 -32.8 70.14 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 -178.506 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HE3' ' HB3' ' A' ' 19' ' ' LYS . 9.1 mmmt -57.74 -55.69 31.65 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.771 177.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.435 ' HA ' ' HB2' ' A' ' 23' ' ' GLN . 7.4 ptm85 -69.36 -25.73 64.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.381 -176.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.7 tp -68.74 -50.7 48.5 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.964 0.411 . . . . 0.0 111.0 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -73.05 -30.75 63.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.462 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.435 ' HB2' ' HA ' ' A' ' 20' ' ' ARG . 18.9 mt-30 -60.24 -57.0 14.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.768 178.13 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.443 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.6 ptm -57.51 -43.11 83.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.095 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.8 tptp -63.07 -39.58 95.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.748 0.309 . . . . 0.0 110.808 177.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -61.61 -50.72 71.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.582 178.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -56.27 -48.57 76.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.012 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 24' ' ' MET . 89.1 t -60.43 -43.0 93.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.101 0.477 . . . . 0.0 110.569 -179.412 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.6 mtp -86.26 13.92 7.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.143 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -110.66 -34.04 6.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.98 0.419 . . . . 0.0 110.555 177.169 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.69 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 25.2 t70 -59.58 127.22 30.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.282 -174.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -69.59 -25.4 63.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.44 -174.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -83.04 -35.96 25.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.409 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.2 t -57.43 -47.13 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.875 0.369 . . . . 0.0 110.46 171.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.69 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 47.8 mt-30 -65.24 -36.65 84.81 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.319 0.581 . . . . 0.0 110.434 179.247 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.55 -39.99 93.09 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.333 175.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.55 ' CD2' HD23 ' A' ' 87' ' ' LEU . 58.0 t80 -66.07 -40.66 91.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.792 176.292 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 38' ' ' LEU . 2.1 mm? -59.79 -42.01 92.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.291 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -80.63 -24.11 39.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.118 0.485 . . . . 0.0 110.655 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.04 -53.24 52.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.556 0.693 . . . . 0.0 110.124 178.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -113.94 31.93 6.21 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.462 -173.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 9.8 pt-20 -62.91 -18.86 63.61 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.573 -178.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -77.71 -27.92 50.78 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.491 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 37.9 t -103.75 -37.18 4.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.55 -173.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.43 HD11 ' CZ ' ' A' ' 37' ' ' PHE . 74.0 mt -80.03 148.43 5.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.681 -174.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -130.06 174.5 9.73 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 174.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 91.8 mt-30 -59.24 -44.55 92.35 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 -175.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -67.17 -36.52 81.95 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.965 0.412 . . . . 0.0 111.149 -175.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 46.7 ttm -58.18 -38.0 75.83 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.842 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.2 mm -68.18 -48.48 73.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.622 176.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -53.47 -48.77 68.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.161 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.619 ' N ' ' HE2' ' A' ' 52' ' ' LYS . 0.8 OUTLIER -65.76 -43.25 89.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 -178.353 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.426 ' O ' HD13 ' A' ' 57' ' ' LEU . 8.3 m -89.95 13.02 15.75 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.189 -173.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.92 -33.9 69.27 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.028 0.442 . . . . 0.0 110.668 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -70.29 -37.44 74.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.585 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.456 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.6 mmmt -69.16 -42.62 75.66 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 120.911 0.386 . . . . 0.0 110.398 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.885 ' HG ' HD21 ' A' ' 87' ' ' LEU . 9.6 mp -61.78 -40.72 96.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.996 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -69.21 -44.37 72.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.104 0.478 . . . . 0.0 110.238 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -54.23 -45.85 72.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.778 174.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.457 ' CG ' HD13 ' A' ' 87' ' ' LEU . 32.9 t80 -60.25 -50.81 72.19 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.846 -1.07 . . . . 0.0 112.768 -178.505 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.469 ' O ' ' HE2' ' A' ' 65' ' ' LYS . 29.8 pt -64.82 -30.28 49.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -173.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.425 ' HG2' HG13 ' A' ' 61' ' ' ILE . 6.7 mm-40 -90.01 -29.69 18.26 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.27 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -85.87 133.13 33.98 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.686 -176.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.481 ' HB3' ' HG3' ' A' ' 85' ' ' PRO . 15.2 t 49.7 40.12 19.22 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.287 0.565 . . . . 0.0 112.254 168.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HE2' ' O ' ' A' ' 61' ' ' ILE . 11.8 ptpt -63.85 -24.32 67.7 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.302 0.572 . . . . 0.0 110.203 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.518 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 34.1 p30 -130.82 -170.35 2.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.026 171.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.0 p -152.58 164.1 38.31 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 176.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.523 ' HB3' ' OE2' ' A' ' 81' ' ' GLU . 31.0 t -63.48 -37.01 85.65 Favored 'General case' 0 C--N 1.317 -0.805 0 O-C-N 123.294 0.371 . . . . 0.0 110.973 -170.089 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.653 ' CZ ' ' HG3' ' A' ' 104' ' ' LYS . 2.6 t80 -55.56 -21.99 19.77 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.246 0.618 . . . . 0.0 111.935 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.5 p -124.28 11.57 8.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.159 0.504 . . . . 0.0 110.204 -179.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.4 ' HB3' ' HA ' ' A' ' 68' ' ' SER . 31.5 t -104.68 121.25 43.19 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.806 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -84.05 -21.9 31.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.805 178.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.03 137.82 32.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.291 174.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -83.72 -21.23 32.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.116 -176.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -100.27 27.95 5.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.052 0.453 . . . . 0.0 111.082 -172.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 31.7 t -80.65 149.94 29.62 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -102.1 112.04 24.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.862 0.363 . . . . 0.0 111.688 -176.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -176.27 149.15 0.82 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.609 173.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.5 mp -100.32 -41.72 6.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.184 0.516 . . . . 0.0 110.49 -177.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.438 ' HG ' ' CE2' ' A' ' 98' ' ' TYR . 3.1 mm? -72.45 112.01 8.14 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.381 -177.066 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.523 ' OE2' ' HB3' ' A' ' 68' ' ' SER . 4.9 tp10 -95.33 138.74 32.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.148 176.074 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 78.05 -7.66 42.68 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.367 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -125.6 153.75 43.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 117.237 0.519 . . . . 0.0 111.2 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.518 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 13.1 m170 -129.5 157.51 76.18 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 168.712 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.481 ' HG3' ' HB3' ' A' ' 64' ' ' SER . 73.0 Cg_endo -80.21 148.53 19.07 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.526 2.151 . . . . 0.0 111.213 176.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.632 ' HB2' ' CD1' ' A' ' 99' ' ' TYR . 20.7 ttpp -137.8 144.11 41.38 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.081 0.467 . . . . 0.0 109.874 175.332 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.885 HD21 ' HG ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -68.69 128.68 37.53 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.744 176.137 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 15.6 m -128.02 145.57 34.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.067 179.043 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 10.8 p -103.69 115.86 46.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.646 0.736 . . . . 0.0 109.881 174.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -114.71 95.51 5.27 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.274 179.036 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.53 -115.08 6.08 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.876 -176.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -107.05 18.61 21.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.069 0.461 . . . . 0.0 111.02 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.0 m -131.05 143.2 50.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.821 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 77.1 mt -102.18 124.15 55.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -121.62 178.33 4.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -175.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.456 HD11 ' O ' ' A' ' 56' ' ' LYS . 54.2 mt -125.02 112.57 32.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.707 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -126.93 158.21 37.42 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.438 ' CE2' ' HG ' ' A' ' 80' ' ' LEU . 12.9 m-85 -97.24 158.28 15.53 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -166.417 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.632 ' CD1' ' HB2' ' A' ' 86' ' ' LYS . 55.3 p90 -139.6 160.92 38.76 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.356 175.302 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -72.32 129.42 38.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.082 0.468 . . . . 0.0 111.586 -179.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 44.0 t -46.88 122.02 7.13 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.607 172.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.89 -22.26 49.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.648 2.232 . . . . 0.0 112.258 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.8 t -68.06 -15.96 20.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.951 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.653 ' HG3' ' CZ ' ' A' ' 69' ' ' TYR . 28.3 tttm -70.01 -21.1 63.24 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.167 0.508 . . . . 0.0 110.263 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 -83.21 39.14 0.64 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.16 -176.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 50.4 tptt . . . . . 0 N--CA 1.442 -0.865 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.721 -178.472 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 tpt . . . . . 0 N--CA 1.477 0.914 0 CA-C-O 120.92 0.391 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -122.81 148.04 52.61 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.537 176.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.85 146.32 79.29 Favored 'Trans proline' 0 CA--C 1.53 0.302 0 C-N-CA 122.965 2.443 . . . . 0.0 112.516 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pp -81.38 165.17 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-O 120.935 0.398 . . . . 0.0 111.567 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -89.16 134.46 12.41 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.379 178.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -153.95 141.33 19.67 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.2 m -81.79 98.33 8.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.823 0.344 . . . . 0.0 110.791 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 8' ' ' LEU . 3.9 mm? -91.24 76.39 6.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.058 0.456 . . . . 0.0 110.319 176.188 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -101.69 -27.49 13.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.906 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.96 153.12 28.08 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.277 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 6.4 m -74.59 93.85 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.701 0.762 . . . . 0.0 110.775 178.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.1 p -76.35 92.33 3.34 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.647 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 133.95 83.35 0.2 Allowed Glycine 0 N--CA 1.442 -0.956 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.985 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -144.32 75.57 15.17 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-O 121.717 0.77 . . . . 0.0 109.835 175.638 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.789 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 33.7 Cg_endo -66.3 144.75 75.56 Favored 'Trans proline' 0 C--O 1.234 0.314 0 C-N-CA 122.58 2.187 . . . . 0.0 112.27 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.602 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 1.5 m-20 -58.64 -37.33 75.71 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.669 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -49.5 -57.1 7.67 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.467 -178.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.789 ' HG2' ' HG2' ' A' ' 15' ' ' PRO . 1.5 pt20 -67.59 -29.65 69.05 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.463 -175.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.725 ' HE2' ' HA ' ' A' ' 19' ' ' LYS . 9.5 mmpt? -68.04 -37.72 81.67 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.864 -0.335 . . . . 0.0 111.296 -178.245 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.602 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 54.3 mtt180 -70.34 -40.7 73.96 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.646 0.736 . . . . 0.0 109.051 174.774 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.6 tp -57.11 -49.31 76.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.232 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 11.0 mm-40 -66.14 -30.56 71.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.15 0.5 . . . . 0.0 110.536 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.487 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 22.5 tt0 -70.12 -53.21 18.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.794 -176.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.485 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.8 ptm -67.82 -36.33 80.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.633 178.595 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -58.13 -42.39 85.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.16 0.505 . . . . 0.0 109.841 175.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.448 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 3.7 tp10 -62.58 -49.31 75.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.961 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -54.51 -48.78 71.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.352 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 24' ' ' MET . 92.3 t -61.12 -45.18 99.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.128 -178.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.7 ptp -82.64 3.4 29.05 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.417 -176.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 13.9 mptt -106.13 -6.13 18.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.688 0.28 . . . . 0.0 110.957 177.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.691 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 15.2 t70 -85.63 129.48 34.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.676 0.274 . . . . 0.0 110.504 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -65.12 -36.74 85.22 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.466 -174.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.43 -38.95 68.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.979 -176.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.4 t -55.75 -49.97 70.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.518 174.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 57.0 mt-30 -61.67 -41.02 96.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.899 -178.613 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.741 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . . . -57.39 -42.1 81.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.72 176.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.501 ' CG ' ' HB3' ' A' ' 87' ' ' LEU . 54.6 t80 -69.62 -39.91 76.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.321 177.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.44 HD11 HD11 ' A' ' 50' ' ' ILE . 1.7 mm? -57.3 -43.28 83.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.41 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.741 ' HE2' ' HA ' ' A' ' 36' ' ' ALA . 52.6 pttt -83.94 -17.76 39.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 111.121 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.83 -52.99 37.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.102 174.172 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -111.33 33.05 4.9 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.721 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.66 -33.14 63.82 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -175.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -82.09 -23.63 35.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.034 0.445 . . . . 0.0 111.128 -177.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.7 t -91.81 -41.88 13.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.193 0.521 . . . . 0.0 110.593 -175.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 37' ' ' PHE . 74.1 mt -73.13 146.67 10.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.549 -178.521 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -120.72 161.29 21.68 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -60.61 -37.85 82.75 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.919 176.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.571 ' O ' ' HG2' ' A' ' 52' ' ' LYS . 13.3 mmmm -63.64 -37.54 87.71 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.172 175.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.547 ' HG2' HG13 ' A' ' 94' ' ' ILE . 46.6 ttm -64.0 -32.38 73.91 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.454 177.641 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.44 HD11 HD11 ' A' ' 38' ' ' LEU . 35.5 mm -62.3 -54.44 34.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.331 -179.511 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 2.0 pt-20 -60.81 -47.1 87.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.842 0.353 . . . . 0.0 111.757 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 48' ' ' LYS . 74.4 mmtt -55.87 -48.08 76.2 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.383 0.611 . . . . 0.0 110.536 178.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.533 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.4 m -94.37 13.61 23.13 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.565 -173.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -54.44 -47.85 72.4 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.537 0.684 . . . . 0.0 110.265 178.81 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -56.22 -40.84 74.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.735 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.527 ' O ' HD11 ' A' ' 96' ' ' ILE . 13.6 mmmm -70.18 -44.04 69.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.994 -179.288 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 53' ' ' SER . 75.1 mt -62.74 -38.88 92.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.24 0.543 . . . . 0.0 110.187 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -69.74 -41.43 75.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.249 177.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.06 -37.78 80.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.012 0.434 . . . . 0.0 110.511 176.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.47 ' CD1' HD13 ' A' ' 87' ' ' LEU . 89.1 t80 -56.38 -50.51 71.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.105 177.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.2 pt -75.49 -29.71 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.812 -178.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -66.42 -46.75 75.46 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.517 177.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -65.81 -175.16 0.27 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.85 -0.613 . . . . 0.0 112.11 -177.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.796 ' HB3' ' HA ' ' A' ' 78' ' ' ASN . 2.9 p -59.92 102.6 0.16 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.193 179.61 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -68.88 -33.1 73.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.469 0.652 . . . . 0.0 110.349 -178.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -124.94 -156.2 0.71 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 173.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.682 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -148.53 152.1 36.26 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 119.659 -0.816 . . . . 0.0 109.843 174.536 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.654 ' HA ' ' O ' ' A' ' 71' ' ' SER . 0.7 OUTLIER -74.68 -23.34 58.61 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.405 -169.951 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.404 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 13.8 t80 -58.26 -20.65 43.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.153 176.17 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.3 p -118.27 -47.05 2.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.967 0.413 . . . . 0.0 110.862 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.654 ' O ' ' HA ' ' A' ' 68' ' ' SER . 8.6 m -100.85 118.37 36.77 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.722 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -83.44 56.57 3.63 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.755 0.788 . . . . 0.0 110.18 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -85.43 122.58 29.78 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.939 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -75.74 -15.43 60.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.037 -173.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -119.15 -2.73 10.68 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -174.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 44.7 t -73.18 114.11 11.0 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.893 0.378 . . . . 0.0 110.433 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -77.31 115.59 17.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.886 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.796 ' HA ' ' HB3' ' A' ' 64' ' ' SER . 10.6 m-80 -111.34 132.46 54.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.401 -176.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.405 HD22 ' N ' ' A' ' 79' ' ' LEU . 3.1 mm? -89.6 -79.25 0.34 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.811 -0.632 . . . . 0.0 109.331 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB3' ' HD2' ' A' ' 83' ' ' TYR . 7.2 mp -87.35 88.39 7.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.062 175.138 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -64.27 144.4 57.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.66 -179.086 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.21 -8.1 72.46 Favored Glycine 0 N--CA 1.445 -0.752 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.201 -177.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.452 ' HD2' ' HB3' ' A' ' 80' ' ' LEU . 61.2 m-85 -121.58 167.34 13.0 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 178.344 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -131.85 145.69 58.58 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 172.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -79.67 135.29 11.46 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.414 2.076 . . . . 0.0 111.709 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.66 139.68 53.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.309 0.576 . . . . 0.0 109.784 173.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.516 HD21 HD22 ' A' ' 57' ' ' LEU . 1.1 tp -77.39 131.52 38.08 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.054 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.453 ' CG2' ' HB3' ' A' ' 95' ' ' ASP . 30.0 m -136.31 170.0 19.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.3 p -112.92 114.52 47.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.368 0.604 . . . . 0.0 110.27 175.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -121.14 107.96 13.22 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.644 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.26 -112.47 3.65 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.396 -178.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.433 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 30.7 mmt180 -117.92 12.01 13.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.167 0.508 . . . . 0.0 109.932 177.474 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 38.1 p -128.36 150.79 49.94 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.078 -177.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.547 HG13 ' HG2' ' A' ' 49' ' ' MET . 77.9 mt -86.38 131.91 33.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 176.502 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.453 ' HB3' ' CG2' ' A' ' 88' ' ' VAL . 13.6 t0 -119.5 169.26 10.2 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.932 -170.1 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.527 HD11 ' O ' ' A' ' 56' ' ' LYS . 60.5 mt -126.86 113.93 35.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.908 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -118.14 159.93 22.43 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 175.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -108.84 129.0 55.39 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.176 0.513 . . . . 0.0 111.527 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 45.8 p90 -108.69 153.84 22.87 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -73.41 135.54 44.21 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.541 -176.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.575 ' SG ' HG12 ' A' ' 103' ' ' VAL . 47.7 t -45.3 126.3 5.86 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.802 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.51 -13.65 22.05 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.364 2.709 . . . . 0.0 113.885 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.575 HG12 ' SG ' ' A' ' 101' ' ' CYS . 9.9 p -66.9 -23.08 30.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 121.041 0.448 . . . . 0.0 110.348 178.213 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 9.0 mmmm -65.83 -28.96 69.37 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.578 0.704 . . . . 0.0 109.85 174.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 105' ' ' ARG . 4.1 mmp_? -104.58 14.57 29.67 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.176 178.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 63.8 pttt . . . . . 0 N--CA 1.466 0.356 0 CA-C-N 114.207 -1.36 . . . . 0.0 112.113 -175.441 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.1 ttt . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 120.744 0.306 . . . . 0.0 110.689 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.486 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 1.2 pm0 -72.4 147.64 90.2 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 175.779 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.91 99.04 0.38 Allowed 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.498 2.132 . . . . 0.0 112.903 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 39.5 mm -87.98 76.36 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -135.07 117.57 1.76 Allowed Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.761 -175.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -123.97 2.48 8.69 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.283 0.563 . . . . 0.0 109.826 174.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.2 m -86.73 14.17 7.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.914 -177.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.5 mp -67.15 -40.63 86.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.704 -179.119 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 81.2 mm-40 -129.86 -61.15 1.01 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.373 0.606 . . . . 0.0 110.395 -179.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.36 -96.6 0.19 Allowed Glycine 0 N--CA 1.446 -0.688 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.209 -177.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.4 t -103.98 94.51 3.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.121 0.486 . . . . 0.0 109.916 177.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.0 t -164.29 154.27 14.39 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.229 178.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.44 ' O ' ' HD3' ' A' ' 14' ' ' ARG . . . 76.4 104.13 0.14 Allowed Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.89 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.44 ' HD3' ' O ' ' A' ' 13' ' ' GLY . 57.9 mmt-85 -142.25 67.88 21.39 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-O 120.924 0.392 . . . . 0.0 110.38 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.647 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 71.9 Cg_endo -84.0 103.5 1.01 Allowed 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.336 2.024 . . . . 0.0 111.138 174.403 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.697 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -65.47 -21.37 66.63 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 121.034 -0.266 . . . . 0.0 110.635 -175.725 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -55.96 -50.95 69.38 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.332 175.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.647 ' HG2' ' HG2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -69.04 -30.67 69.08 Favored 'General case' 0 C--O 1.226 -0.179 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -178.781 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 29.5 mmmt -60.33 -47.74 84.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.354 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.697 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 14.0 mtm-85 -71.06 -53.31 15.15 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.1 -51.11 70.61 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.506 -174.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -75.98 -28.28 57.78 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 -176.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 52.3 tt0 -64.45 -55.84 18.2 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.079 176.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.604 ' O ' HG23 ' A' ' 28' ' ' VAL . 27.6 ptm -62.0 -40.78 96.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.72 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HA ' HD21 ' A' ' 54' ' ' LEU . 80.8 tttt -62.8 -42.58 99.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.43 -178.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.494 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 14.3 tt0 -62.68 -45.97 90.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.864 0.364 . . . . 0.0 110.106 177.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.0 mtpt -55.46 -45.21 76.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.456 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 24' ' ' MET . 72.1 t -61.77 -42.42 94.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.678 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.8 ptp -84.77 14.61 4.57 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.29 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.494 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 2.4 mptm? -115.25 -14.83 11.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.059 176.092 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.639 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 19.6 t70 -74.16 135.33 42.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.069 0.461 . . . . 0.0 110.662 -177.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -66.72 -36.67 83.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.965 -175.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -75.3 -35.86 61.22 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.017 0.437 . . . . 0.0 110.065 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.1 t -59.66 -41.01 83.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.487 174.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.639 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 74.1 mm-40 -57.15 -49.03 77.2 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.139 0.495 . . . . 0.0 110.04 176.225 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -56.14 -40.54 73.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.476 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.32 -43.54 85.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.809 0.337 . . . . 0.0 110.981 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.526 HD11 HD11 ' A' ' 50' ' ' ILE . 3.5 mm? -63.02 -43.25 99.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.824 -177.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -70.77 -32.62 69.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.188 0.518 . . . . 0.0 110.721 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -74.36 -29.57 61.62 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.333 -177.727 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -118.27 28.54 8.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.184 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -63.34 -16.95 61.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.608 0.718 . . . . 0.0 109.931 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -73.89 -25.84 60.23 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.908 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.9 t -119.96 -33.73 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -170.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.515 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 73.1 mt -71.8 143.83 13.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.358 0.599 . . . . 0.0 112.203 -172.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -120.1 166.65 13.12 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.91 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -62.52 -41.64 98.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.333 0.587 . . . . 0.0 109.588 174.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -63.89 -37.64 88.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.618 -179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.515 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 54.0 ttm -58.56 -39.44 80.27 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.551 176.398 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.526 HD11 HD11 ' A' ' 38' ' ' LEU . 46.6 mm -67.29 -48.31 78.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.742 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -61.78 -37.77 85.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.288 -178.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.473 ' C ' ' HD3' ' A' ' 52' ' ' LYS . 1.1 tmtp? -71.7 -45.99 60.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.386 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.8 m -92.46 16.55 11.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.452 -173.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -56.52 -40.07 74.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.255 0.55 . . . . 0.0 110.383 178.934 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -62.1 -45.67 92.44 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.462 177.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.467 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.6 mmmt -64.88 -49.57 69.99 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.891 0.377 . . . . 0.0 110.752 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.413 ' CD2' ' HG ' ' A' ' 87' ' ' LEU . 90.0 mt -60.76 -39.12 87.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.886 -178.239 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -69.9 -43.08 72.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.696 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -61.2 -31.74 71.5 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.336 0.589 . . . . 0.0 109.839 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.477 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 34.4 t80 -66.4 -46.23 77.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.189 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' A' ' 28' ' ' VAL . 31.2 pt -75.5 -29.01 20.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -176.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -74.23 -35.62 63.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.533 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 19.4 pt20 -75.4 -175.76 2.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.027 0.441 . . . . 0.0 111.016 -178.398 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.0 t -71.35 93.71 1.16 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.299 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -73.83 -26.98 60.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.29 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -96.09 -172.75 2.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.441 177.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.579 ' HA ' ' ND2' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -141.56 154.21 45.31 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.602 179.573 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 71' ' ' SER . 17.5 m -72.4 -11.06 60.53 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.847 -173.23 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -79.5 -3.56 47.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.093 0.473 . . . . 0.0 110.584 176.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 26.0 p -132.42 -27.55 1.75 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.153 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.513 ' O ' ' HA ' ' A' ' 68' ' ' SER . 19.2 m -114.52 115.8 27.8 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 175.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -76.21 -29.25 57.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -173.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -62.86 131.43 48.76 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.586 0.708 . . . . 0.0 110.98 -169.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -62.99 -22.45 66.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.739 -172.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 -64.77 -22.19 66.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.959 0.409 . . . . 0.0 110.967 -177.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 53.1 m -111.01 25.98 11.19 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.999 -178.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -63.58 143.96 57.4 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.158 0.504 . . . . 0.0 110.641 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.579 ' ND2' ' HA ' ' A' ' 67' ' ' CYS . 0.3 OUTLIER -135.61 139.14 43.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.862 -177.046 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.498 ' HG ' ' N ' ' A' ' 80' ' ' LEU . 2.5 pt? -59.72 -52.26 66.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.216 -179.357 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.517 ' HG ' ' HB2' ' A' ' 83' ' ' TYR . 12.8 tp -86.93 74.74 9.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.304 0.574 . . . . 0.0 109.934 177.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -72.43 146.69 46.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.714 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.56 -8.94 76.64 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.606 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' TYR . . . . . 0.517 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 47.8 m-85 -123.65 164.84 18.27 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.484 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 12.6 m170 -128.33 146.79 61.08 Favored Pre-proline 0 CA--C 1.509 -0.616 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 172.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' PRO . . . . . 0.539 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 56.5 Cg_endo -75.55 138.47 21.78 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.114 1.876 . . . . 0.0 111.064 172.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.439 ' HD2' ' HD1' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -142.3 153.07 43.58 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.082 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.418 ' CD1' HG12 ' A' ' 96' ' ' ILE . 2.2 mm? -79.21 147.3 32.66 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.882 0.372 . . . . 0.0 110.517 -177.005 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 25.3 m -131.37 135.63 59.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.633 174.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.1 p -90.38 114.62 28.28 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-O 121.098 0.475 . . . . 0.0 110.832 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -119.38 95.74 4.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.494 178.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.74 -123.93 7.73 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.554 -1.018 . . . . 0.0 110.554 -174.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -103.77 10.44 36.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.957 0.408 . . . . 0.0 110.33 173.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 24.8 m -116.11 135.91 53.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 78.1 mt -101.84 133.44 45.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.385 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.421 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 3.6 t70 -118.0 178.6 4.36 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -177.57 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.467 HD11 ' O ' ' A' ' 56' ' ' LYS . 53.3 mt -127.31 113.39 31.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 120.705 0.288 . . . . 0.0 110.944 -176.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.539 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 29.8 mm-40 -113.86 -173.89 2.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.01 179.011 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.484 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 10.3 m-85 -128.82 150.11 50.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.016 0.436 . . . . 0.0 111.926 -177.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.439 ' HD1' ' HD2' ' A' ' 86' ' ' LYS . 53.3 p90 -136.46 158.13 45.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.088 174.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -71.74 132.59 44.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.376 0.608 . . . . 0.0 111.862 -177.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 33.7 t -57.88 122.6 58.52 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.192 173.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.65 -23.14 70.07 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.419 2.079 . . . . 0.0 112.301 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.744 ' HA ' ' HG3' ' A' ' 106' ' ' LYS . 44.8 t -64.93 -19.74 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 121.239 0.542 . . . . 0.0 110.823 178.174 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.641 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 1.0 OUTLIER -64.51 -23.98 67.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.065 178.471 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -131.57 35.72 3.81 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.148 0.499 . . . . 0.0 111.107 -172.339 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.744 ' HG3' ' HA ' ' A' ' 103' ' ' VAL . 9.2 mtpm? . . . . . 0 C--O 1.237 0.445 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.47 174.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.639 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 22.0 t70 . . . . . 0 N--CA 1.462 0.133 0 CA-C-O 121.223 0.535 . . . . 0.0 109.984 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -52.78 -41.32 64.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.475 175.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -70.36 -29.46 66.14 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -178.297 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.639 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 46.9 mtpt -64.9 -39.8 94.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.943 177.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 23.7 mtp180 -66.17 -48.02 72.09 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 174.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.435 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 32.2 tp -54.32 -50.17 67.99 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.138 -1.392 . . . . 0.0 112.488 -177.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -71.98 -28.86 63.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.84 0.353 . . . . 0.0 110.873 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -70.66 -50.3 38.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.878 0.37 . . . . 0.0 110.082 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.499 ' O ' HG23 ' A' ' 28' ' ' VAL . 23.1 ptm -67.23 -36.59 81.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.713 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -54.17 -50.57 66.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.115 176.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -68.45 -46.35 70.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.131 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mmmt -53.16 -44.77 68.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 24' ' ' MET . 93.4 t -63.62 -42.47 96.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.011 0.434 . . . . 0.0 110.076 177.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 64.5 mtt -81.81 17.7 1.45 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.138 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -118.39 -11.71 9.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.066 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.608 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 13.7 t70 -85.44 145.77 27.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.86 0.362 . . . . 0.0 110.449 -177.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 -75.46 -35.47 60.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.668 -173.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -68.97 -40.41 78.89 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.82 -43.93 85.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.834 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.608 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 75.4 mm-40 -56.25 -49.88 72.92 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.242 0.544 . . . . 0.0 110.346 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.45 -49.34 78.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.243 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -63.91 -41.95 97.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.222 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.443 HD11 HD11 ' A' ' 50' ' ' ILE . 1.1 mm? -55.52 -51.42 67.07 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.105 -178.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.456 ' HB3' ' HE2' ' A' ' 39' ' ' LYS . 15.5 ptpt -74.67 -24.39 58.79 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.901 0.381 . . . . 0.0 110.99 -177.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -63.79 -46.2 86.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.307 0.575 . . . . 0.0 110.378 177.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -114.88 26.45 10.15 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.665 -176.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.412 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 10.8 pt-20 -67.89 -18.19 64.72 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.835 0.35 . . . . 0.0 111.501 -176.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -73.45 -26.46 60.95 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.287 0.565 . . . . 0.0 109.794 175.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.7 t -99.2 -42.58 10.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.056 -176.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.4 mt -80.15 144.2 11.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.378 -175.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -114.31 163.31 15.46 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.936 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -55.22 -43.15 74.24 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.309 0.576 . . . . 0.0 111.265 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -69.55 -36.31 76.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.287 -178.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 57.8 ttm -56.13 -38.59 71.03 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.529 174.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.443 HD11 HD11 ' A' ' 38' ' ' LEU . 42.6 mm -61.77 -47.25 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.988 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 46.3 mt-10 -70.91 -30.62 67.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.499 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -70.68 -43.59 68.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.671 0.272 . . . . 0.0 110.752 176.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.0 m -92.92 19.61 7.54 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.41 -179.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -51.74 -51.72 54.02 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.13 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -52.94 -45.08 67.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.579 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.487 ' O ' HD11 ' A' ' 96' ' ' ILE . 38.3 mmtm -63.68 -53.69 47.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.211 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.36 -33.58 75.84 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.695 -177.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.401 ' O ' ' HB3' ' A' ' 62' ' ' GLU . 42.9 t80 -73.65 -41.0 63.3 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.871 0.367 . . . . 0.0 110.477 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.449 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 42.1 tt0 -65.88 -33.04 74.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.495 0.664 . . . . 0.0 109.882 177.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -58.71 -51.61 69.24 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.6 177.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.0 pt -75.17 -28.25 20.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.876 -176.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.401 ' HB3' ' O ' ' A' ' 58' ' ' TYR . 0.0 OUTLIER -73.83 -33.06 64.0 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.031 -175.327 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 47.5 mt-30 -81.02 179.48 7.84 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.875 0.369 . . . . 0.0 111.145 -178.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.1 t -66.65 117.06 8.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.692 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -75.23 -27.0 59.35 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.394 0.616 . . . . 0.0 110.175 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -102.55 -160.89 0.81 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.41 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -154.46 157.84 39.03 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 177.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.6 t -79.21 -9.83 59.67 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.194 0.521 . . . . 0.0 110.703 -172.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -69.69 -11.56 60.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.211 0.529 . . . . 0.0 110.604 173.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 17.8 p -126.49 -40.33 1.95 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.255 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.2 m -99.0 153.44 18.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.1 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.44 16.12 6.92 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.229 0.538 . . . . 0.0 110.691 178.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -68.16 86.21 0.26 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.833 176.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -80.41 -11.27 59.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.055 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -81.1 -13.42 58.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.615 -175.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 66.9 m -87.96 115.53 25.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.516 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -78.06 108.11 11.1 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.245 177.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -120.12 135.63 54.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.817 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.668 ' HG ' HD22 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -104.29 -35.93 7.8 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.166 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.668 HD22 ' HG ' ' A' ' 79' ' ' LEU . 3.2 mm? -87.12 49.19 1.77 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.976 170.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -67.41 147.5 52.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.33 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 94.0 -9.03 73.14 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.467 -173.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.42 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 56.2 m-85 -125.0 171.81 9.93 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.452 ' HB2' ' CZ ' ' A' ' 99' ' ' TYR . 16.9 m170 -130.5 147.48 66.11 Favored Pre-proline 0 C--N 1.329 -0.291 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 171.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.96 135.49 15.64 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.363 2.042 . . . . 0.0 112.472 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -136.95 146.33 45.27 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 172.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.6 mt -80.72 142.95 33.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.802 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 23.2 m -139.94 141.36 34.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.938 175.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.1 p -93.37 114.68 30.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.498 0.666 . . . . 0.0 110.454 179.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -116.0 96.68 5.69 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.676 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.95 -112.98 4.71 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.665 -177.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.494 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 8.0 mpt_? -106.85 0.9 24.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.909 0.385 . . . . 0.0 110.965 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 12.2 p -121.5 147.58 45.59 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.006 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 55.9 mt -103.66 124.57 58.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.956 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -109.77 177.62 4.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.245 0.545 . . . . 0.0 110.839 -175.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.487 HD11 ' O ' ' A' ' 56' ' ' LYS . 47.4 mt -126.53 105.88 14.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.283 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -105.46 150.75 25.02 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.237 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.42 ' CD2' ' HB2' ' A' ' 83' ' ' TYR . 17.2 m-85 -100.17 126.87 46.49 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.056 179.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.452 ' CZ ' ' HB2' ' A' ' 84' ' ' HIS . 54.3 p90 -105.49 144.34 32.39 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 173.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -63.2 138.71 58.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.111 0.481 . . . . 0.0 111.069 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 40.6 t -56.63 123.37 57.0 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.456 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.07 -17.15 58.78 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.815 2.343 . . . . 0.0 112.213 -178.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.9 t -69.63 -15.76 19.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.827 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt . . . . . 0 C--O 1.234 0.264 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.27 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.473 ' HA ' ' HG3' ' A' ' 19' ' ' LYS . 2.9 m-20 . . . . . 0 CA--C 1.52 -0.183 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -65.16 -54.89 22.82 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.483 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 3.2 pt20 -66.88 -30.23 70.34 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.41 178.145 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.473 ' HG3' ' HA ' ' A' ' 16' ' ' ASP . 5.9 mmmm -57.98 -48.41 80.06 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 174.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.422 ' O ' ' HG2' ' A' ' 24' ' ' MET . 2.6 tpp180 -66.57 -45.2 80.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.385 177.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.483 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 26.8 tp -53.94 -49.42 68.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.319 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -67.02 -40.36 87.24 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.922 177.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 27.3 tt0 -59.29 -51.33 70.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.827 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.426 ' O ' HG23 ' A' ' 28' ' ' VAL . 18.1 ptm -73.55 -37.37 65.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.078 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.496 ' HE2' ' HG2' ' A' ' 51' ' ' GLU . 4.5 tppp? -59.76 -40.51 88.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 110.143 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.68 -50.53 70.78 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.323 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -58.14 -47.0 84.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.524 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.529 ' HA ' HD13 ' A' ' 61' ' ' ILE . 74.8 t -62.66 -42.23 95.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.063 -177.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 24.3 mmt -82.98 15.52 2.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.751 0.31 . . . . 0.0 111.279 -178.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -107.27 -20.38 13.3 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.083 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.689 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 35.1 t70 -77.37 131.36 38.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.937 0.399 . . . . 0.0 111.237 -175.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -59.45 -45.61 91.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.808 -177.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -67.56 -39.43 84.93 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.423 -177.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.8 t -54.83 -49.61 68.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.661 174.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.689 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 36.0 mt-30 -64.38 -40.41 95.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.232 0.539 . . . . 0.0 110.607 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.429 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -59.77 -38.85 82.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.33 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.505 ' CZ ' HG23 ' A' ' 89' ' ' VAL . 59.3 t80 -69.82 -44.26 70.33 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.735 177.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.553 HD11 HD11 ' A' ' 50' ' ' ILE . 1.2 mm? -54.41 -47.91 72.23 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.355 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.6 pttt -76.11 -27.06 56.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.028 0.442 . . . . 0.0 111.114 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 5.3 tp10 -65.57 -42.45 91.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.134 0.492 . . . . 0.0 110.124 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -116.01 27.67 9.11 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.161 -176.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -66.94 -16.1 64.11 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.971 0.415 . . . . 0.0 111.734 -175.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -77.85 -19.41 54.91 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.109 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 40.4 t -113.68 -40.74 3.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.992 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.537 ' CG1' HG21 ' A' ' 89' ' ' VAL . 62.4 mt -72.09 141.92 15.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.499 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -115.48 164.1 14.78 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.461 -0.79 . . . . 0.0 108.87 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -59.92 -40.19 88.01 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -64.88 -38.17 90.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.648 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.6 tpp -58.73 -41.75 87.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.325 177.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.553 HD11 HD11 ' A' ' 38' ' ' LEU . 44.6 mm -61.95 -45.81 97.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.856 178.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.761 ' HA ' HD23 ' A' ' 54' ' ' LEU . 34.2 mt-10 -70.35 -33.85 71.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.126 -178.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -64.07 -41.52 97.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.125 0.488 . . . . 0.0 110.123 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.4 m -107.18 27.46 9.02 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.087 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.761 HD23 ' HA ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -55.29 -46.21 76.21 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 121.151 0.501 . . . . 0.0 110.024 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -63.72 -29.64 70.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.017 -176.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.471 ' O ' HD11 ' A' ' 96' ' ' ILE . 65.0 mmtt -68.19 -53.98 21.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.092 0.473 . . . . 0.0 110.103 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.2 mp -65.63 -36.74 84.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.724 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -65.83 -42.16 90.87 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.18 -0.463 . . . . 0.0 109.898 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -58.07 -48.21 80.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.619 175.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.404 ' HD1' ' HB2' ' A' ' 85' ' ' PRO . 51.5 t80 -56.13 -49.26 74.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.47 -177.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.529 HD13 ' HA ' ' A' ' 28' ' ' VAL . 29.7 pt -75.13 -29.55 21.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -174.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -80.39 -30.69 37.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.661 0.267 . . . . 0.0 111.3 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -77.91 -171.78 2.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.159 0.504 . . . . 0.0 110.926 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 31.6 p -74.38 94.03 2.49 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.463 177.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -64.45 -32.93 74.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.614 0.721 . . . . 0.0 109.399 173.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.477 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.0 t-20 -92.22 -159.93 0.7 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.128 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.486 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -153.95 149.57 27.41 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.447 175.604 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.49 ' HA ' ' O ' ' A' ' 71' ' ' SER . 13.7 t -75.21 0.65 15.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.82 -173.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.446 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 5.3 t80 -82.41 -12.68 57.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.199 176.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.477 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 25.6 p -127.53 -40.81 1.75 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.57 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.49 ' O ' ' HA ' ' A' ' 68' ' ' SER . 50.2 p -98.34 149.29 22.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 174.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 14.9 tt0 -102.35 -2.93 27.93 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.782 -176.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.578 ' HB2' HD22 ' A' ' 75' ' ' ASN . 1.8 p30 -58.33 133.25 55.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.469 0.652 . . . . 0.0 110.557 -176.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -94.76 5.44 51.86 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.334 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . 0.578 HD22 ' HB2' ' A' ' 73' ' ' ASP . 53.2 m-80 -68.55 -39.74 80.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.889 -177.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 21.8 p -110.44 114.56 28.09 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.965 0.412 . . . . 0.0 110.181 176.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -74.86 107.47 6.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.676 0.751 . . . . 0.0 109.908 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.707 ' OD1' ' HA ' ' A' ' 81' ' ' GLU . 2.9 t-20 -87.98 103.75 15.98 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.772 -176.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 mp -65.53 -65.53 0.66 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.251 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.2 mp -80.4 77.14 7.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.348 174.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.707 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 29.8 tt0 -73.95 132.54 42.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.598 -175.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.14 -7.53 48.13 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.357 -176.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -122.29 162.91 20.61 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -126.04 147.22 58.49 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 169.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.404 ' HB2' ' HD1' ' A' ' 60' ' ' TYR . 46.2 Cg_endo -71.78 136.79 28.52 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.315 2.01 . . . . 0.0 112.358 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.476 ' HB3' ' CD1' ' A' ' 99' ' ' TYR . 20.6 ptmt -128.11 131.72 49.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.416 179.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 76.2 mt -78.92 134.66 36.86 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.177 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.2 m -132.18 139.68 49.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.121 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.537 HG21 ' CG1' ' A' ' 45' ' ' ILE . 78.8 t -88.98 114.67 27.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.405 0.621 . . . . 0.0 109.673 175.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -117.05 95.32 4.94 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.133 -172.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.17 -113.94 6.29 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.062 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.526 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 0.2 OUTLIER -105.7 18.34 22.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.752 0.31 . . . . 0.0 111.386 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.3 m -138.98 167.62 21.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.09 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 76.2 mt -114.68 131.71 66.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -115.62 177.57 4.62 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 -176.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.471 HD11 ' O ' ' A' ' 56' ' ' LYS . 51.0 mt -132.98 108.88 13.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.285 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -99.55 -174.93 2.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.809 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -133.37 124.26 26.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.927 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.476 ' CD1' ' HB3' ' A' ' 86' ' ' LYS . 55.2 p90 -107.22 152.12 24.52 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 100' ' ' GLU . 0.6 OUTLIER -74.14 130.29 39.49 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.417 0.627 . . . . 0.0 110.616 -175.876 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.41 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 48.9 t -46.31 122.88 6.75 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.587 174.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 14.7 Cg_endo -60.51 -9.58 11.45 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.132 2.555 . . . . 0.0 113.099 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 91.8 t -78.44 -25.23 13.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 177.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.9 tttp . . . . . 0 C--N 1.332 -0.175 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.605 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.469 0.493 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -52.46 -46.97 66.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.2 177.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.423 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -71.43 -30.06 65.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.243 0.544 . . . . 0.0 110.04 -177.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -71.13 -42.54 69.08 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.382 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -72.52 -32.26 65.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.751 0.31 . . . . 0.0 110.577 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 tp -65.22 -49.48 69.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.388 177.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.582 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 7.0 mm-40 -73.18 -25.0 60.62 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.923 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -61.96 -56.91 14.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.759 0.314 . . . . 0.0 111.398 174.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.533 ' O ' HG23 ' A' ' 28' ' ' VAL . 23.7 ptm -61.14 -35.56 77.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.956 0.407 . . . . 0.0 109.995 176.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.582 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 4.1 tptm -57.78 -46.18 84.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.923 173.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -53.11 -49.25 66.87 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 123.665 0.786 . . . . 0.0 111.103 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mmmm -59.02 -49.42 77.97 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.783 177.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 24' ' ' MET . 57.6 t -64.18 -41.24 91.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.723 -175.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 14.8 ptp -73.73 -4.72 36.23 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -171.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -127.62 -4.08 5.95 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.484 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 0.3 OUTLIER -77.38 126.74 31.39 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.179 0.514 . . . . 0.0 110.239 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -66.68 -33.01 74.7 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.972 -168.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -66.46 -41.23 89.37 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.789 0.328 . . . . 0.0 110.236 177.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 91.3 t -58.28 -44.82 88.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.289 172.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 84.4 mm-40 -55.38 -50.47 69.64 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.922 178.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -54.67 -42.62 71.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.26 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -68.85 -43.44 75.45 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.692 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.712 HD11 HD11 ' A' ' 50' ' ' ILE . 2.4 mm? -61.03 -44.7 97.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.445 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.419 ' HE2' ' HB2' ' A' ' 39' ' ' LYS . 4.1 ptmm? -70.83 -26.05 63.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.045 0.45 . . . . 0.0 110.508 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -73.85 -44.23 56.16 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.974 0.416 . . . . 0.0 110.588 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -112.74 29.02 8.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.505 -176.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -64.22 -22.54 66.98 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.031 0.444 . . . . 0.0 111.354 -176.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -75.11 -25.99 58.91 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.534 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.5 t -101.07 -42.37 9.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.99 -174.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.531 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 65.3 mt -77.87 142.63 13.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.794 -175.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -118.24 165.7 13.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.707 176.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -55.68 -44.33 77.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.901 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.406 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 51.6 mtpt -66.14 -36.89 84.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.086 0.469 . . . . 0.0 110.706 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.531 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 23.0 ttt -60.13 -35.83 76.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.201 177.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.712 HD11 HD11 ' A' ' 38' ' ' LEU . 37.0 mm -64.57 -54.45 30.24 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.839 176.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.516 ' HA ' HD23 ' A' ' 54' ' ' LEU . 7.7 mm-40 -57.53 -42.18 82.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.024 0.44 . . . . 0.0 111.014 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -65.36 -29.73 70.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.082 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.447 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 7.3 m -114.26 20.5 15.49 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.38 -178.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.516 HD23 ' HA ' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -58.88 -44.7 91.19 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.922 -177.633 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -60.6 -33.67 73.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.782 178.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.574 ' O ' HD11 ' A' ' 96' ' ' ILE . 32.1 mmmt -73.22 -42.76 62.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 110.91 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.446 HD21 HG21 ' A' ' 94' ' ' ILE . 76.2 mt -65.51 -38.79 90.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.143 0.497 . . . . 0.0 110.132 177.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -70.3 -39.26 74.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.115 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.523 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 38.0 tt0 -57.21 -39.72 76.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.012 175.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -59.51 -52.21 66.55 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.525 177.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.7 pt -74.34 -29.0 23.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -174.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.523 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 7.6 pt-20 -75.63 -20.73 58.31 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.811 178.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 46.3 mt-30 -74.36 -167.15 0.49 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.925 0.393 . . . . 0.0 110.322 174.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.561 ' HB2' ' C ' ' A' ' 77' ' ' ASN . 20.0 t -83.74 130.16 34.95 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.881 0.372 . . . . 0.0 111.212 -177.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -73.05 -26.6 61.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.533 0.682 . . . . 0.0 109.574 173.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.487 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 76.6 m-20 -122.78 -160.09 0.87 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.608 -177.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.435 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 6.8 p -152.63 161.11 43.01 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 176.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.606 ' HB3' ' HG3' ' A' ' 81' ' ' GLU . 48.1 t -60.24 -29.22 68.63 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 123.49 0.494 . . . . 0.0 111.285 -174.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -72.37 -1.92 17.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.032 0.444 . . . . 0.0 111.617 -178.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.9 p -136.31 6.94 3.08 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.591 175.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 38.5 t -145.35 118.65 8.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.865 0.364 . . . . 0.0 110.302 -176.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -81.81 -6.69 59.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.03 177.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -79.73 134.13 36.37 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.019 -174.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -64.28 -26.4 68.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.079 -0.51 . . . . 0.0 112.328 -176.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -81.49 67.45 7.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.824 0.821 . . . . 0.0 110.238 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.451 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 15.7 p -115.51 116.92 29.0 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.454 172.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.561 ' C ' ' HB2' ' A' ' 64' ' ' SER . 56.4 m-20 -79.08 21.81 0.43 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.653 -173.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.454 ' N ' ' HB2' ' A' ' 64' ' ' SER . 3.0 p-10 -103.66 128.06 51.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.153 0.501 . . . . 0.0 111.272 -177.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.868 ' HG ' HD12 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -90.73 -26.89 19.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 168.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.868 HD12 ' HG ' ' A' ' 79' ' ' LEU . 5.5 mp -85.51 110.3 19.1 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.258 173.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.606 ' HG3' ' HB3' ' A' ' 68' ' ' SER . 33.5 tt0 -88.48 142.05 28.03 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.091 0.472 . . . . 0.0 110.541 -179.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.2 -8.78 77.44 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.887 176.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -126.43 160.3 30.89 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.919 0.359 . . . . 0.0 110.989 -177.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.487 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 13.1 m170 -128.07 149.32 70.67 Favored Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.005 177.157 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.98 153.54 25.33 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.548 2.166 . . . . 0.0 112.166 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -152.6 151.96 31.25 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -82.57 142.65 31.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.964 0.411 . . . . 0.0 110.346 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.493 ' CG2' ' HB3' ' A' ' 95' ' ' ASP . 33.1 m -132.49 155.42 41.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.622 176.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.42 HG23 ' CE ' ' A' ' 49' ' ' MET . 4.3 p -99.92 115.15 40.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-O 121.168 0.508 . . . . 0.0 110.08 175.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -120.17 95.82 4.9 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.866 177.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.64 -124.11 28.41 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.088 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -96.59 13.9 26.61 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.83 0.348 . . . . 0.0 111.0 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.5 m -125.24 144.42 50.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.663 -178.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.447 ' HB ' ' CB ' ' A' ' 53' ' ' SER . 60.8 mt -97.56 131.78 43.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 174.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.493 ' HB3' ' CG2' ' A' ' 88' ' ' VAL . 41.3 t0 -126.46 178.08 6.08 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.745 0.307 . . . . 0.0 110.254 -170.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.574 HD11 ' O ' ' A' ' 56' ' ' LYS . 77.0 mt -124.39 129.94 73.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-O 121.249 0.547 . . . . 0.0 110.273 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -122.49 172.33 8.44 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.283 177.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -124.42 134.99 52.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.008 0.432 . . . . 0.0 111.268 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -118.21 151.2 38.08 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.588 ' HG2' ' HD3' ' A' ' 104' ' ' LYS . 24.4 tt0 -71.84 137.19 47.36 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.979 0.419 . . . . 0.0 110.582 -175.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.443 ' SG ' HG12 ' A' ' 103' ' ' VAL . 19.8 t -47.58 124.8 9.8 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.505 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.37 -10.91 25.74 Favored 'Trans proline' 0 N--CA 1.474 0.337 0 C-N-CA 123.198 2.599 . . . . 0.0 113.493 -176.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.443 HG12 ' SG ' ' A' ' 101' ' ' CYS . 9.8 p -66.61 -19.39 25.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.282 0.563 . . . . 0.0 110.306 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.588 ' HD3' ' HG2' ' A' ' 100' ' ' GLU . 8.3 mtpm? . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.219 -178.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 . . . . . 0 C--O 1.234 0.261 0 CA-C-O 120.935 0.398 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -52.17 -47.64 65.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.537 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.409 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 1.7 pt20 -68.88 -30.75 69.32 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.208 -175.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 30.3 mmtm -72.13 -38.16 69.32 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -175.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.405 ' HD2' HH11 ' A' ' 20' ' ' ARG . 19.1 ptt85 -75.52 -23.78 56.73 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.444 176.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.4 tp -70.48 -48.57 55.12 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.12 174.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 18' ' ' GLN . 37.0 mt-10 -58.92 -43.2 91.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.884 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -58.29 -53.71 55.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.999 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.629 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.3 ptm -68.68 -42.3 78.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.287 -177.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -61.25 -43.06 99.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.719 0.295 . . . . 0.0 110.777 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -64.88 -46.4 81.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.059 0.457 . . . . 0.0 110.173 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -55.75 -45.39 78.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.949 178.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 24' ' ' MET . 74.3 t -62.08 -37.54 78.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.939 0.4 . . . . 0.0 110.79 -179.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.8 mtp -82.3 -2.97 54.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.59 -178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -103.8 -6.57 21.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.305 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.413 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 26.1 t70 -77.93 137.61 38.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.824 0.345 . . . . 0.0 110.489 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -67.57 -43.47 80.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.483 -175.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -70.42 -43.67 69.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.53 -177.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.9 t -54.99 -55.18 17.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.855 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 2.1 pt20 -65.61 -34.21 77.7 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -176.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.91 -41.61 86.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.265 0.555 . . . . 0.0 110.192 175.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.507 ' HZ ' HG23 ' A' ' 89' ' ' VAL . 88.4 t80 -61.8 -38.94 89.99 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.812 176.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.82 HD11 HD11 ' A' ' 50' ' ' ILE . 1.6 mm? -61.25 -50.47 72.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.794 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -70.0 -23.1 63.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.025 0.44 . . . . 0.0 111.054 -177.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -76.15 -37.52 57.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.958 176.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -110.71 25.18 12.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.701 -174.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -63.67 -20.78 65.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.076 0.465 . . . . 0.0 111.311 -176.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -75.5 -20.44 58.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.574 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.4 t -108.06 -46.98 7.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.802 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 89' ' ' VAL . 54.6 mt -81.33 144.16 10.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.979 -173.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.494 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -130.83 -178.65 4.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.442 176.454 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -64.36 -42.25 96.31 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -60.03 -44.79 94.39 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.589 0.233 . . . . 0.0 110.609 177.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.421 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 38.5 ttm -56.25 -38.95 71.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.537 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.82 HD11 HD11 ' A' ' 38' ' ' LEU . 46.1 mm -60.52 -54.12 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.945 177.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -62.09 -38.11 87.63 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.129 0.49 . . . . 0.0 111.068 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -69.68 -26.46 64.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.608 -178.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 77.3 p -114.37 16.48 17.82 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.265 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.94 -42.68 69.09 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.456 0.646 . . . . 0.0 110.508 178.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.519 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 24.4 p-10 -59.67 -44.46 93.59 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.738 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.589 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.1 mmmt -67.48 -49.94 61.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.557 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.6 -41.07 76.39 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.531 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -67.39 -42.77 82.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.072 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 15.9 mm-40 -58.87 -39.36 81.12 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-O 120.9 0.381 . . . . 0.0 110.763 177.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -58.88 -51.33 70.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.531 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.6 pt -71.64 -29.69 35.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.702 -174.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.75 -23.25 55.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.014 0.435 . . . . 0.0 111.093 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 46.9 mt-30 -80.26 167.75 19.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.048 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.2 m -66.9 113.4 4.92 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.52 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -64.83 -26.19 68.23 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.781 172.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -102.19 -163.18 0.98 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.664 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.7 p -159.6 158.04 30.9 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.0 m -67.32 -25.4 66.0 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.067 0.461 . . . . 0.0 110.775 -172.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 104' ' ' LYS . 1.3 t80 -67.76 -5.89 18.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.57 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 28.7 p -135.92 2.63 2.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.749 0.309 . . . . 0.0 111.1 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.8 m -124.33 145.27 49.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.898 0.38 . . . . 0.0 110.16 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -77.26 -13.55 59.92 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.271 0.557 . . . . 0.0 110.844 -175.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.552 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 0.3 OUTLIER -80.13 87.06 5.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.435 179.561 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -68.37 -11.13 59.11 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.583 0.706 . . . . 0.0 110.151 175.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -73.71 -17.58 61.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.218 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.552 ' SG ' ' HB3' ' A' ' 73' ' ' ASP . 59.8 m -71.27 117.4 12.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.892 0.377 . . . . 0.0 111.023 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -87.31 99.83 12.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.996 0.427 . . . . 0.0 110.007 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -102.05 129.75 48.44 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.499 -177.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.596 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.5 pt? -66.9 -24.35 66.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.415 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.485 HD12 ' HG ' ' A' ' 79' ' ' LEU . 5.3 mp -141.96 103.84 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 174.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -94.69 150.49 20.17 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 -176.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.52 -9.41 77.18 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.389 -174.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -124.18 166.99 14.88 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 99' ' ' TYR . 16.7 m170 -127.62 146.84 60.12 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 169.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.3 145.77 39.13 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.063 1.842 . . . . 0.0 111.513 175.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -142.03 149.63 40.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.096 177.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.7 mt -83.59 135.59 34.56 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.058 177.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.478 HG11 ' HG3' ' A' ' 97' ' ' GLU . 29.7 m -133.81 150.63 31.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.616 HG22 HG12 ' A' ' 94' ' ' ILE . 48.4 t -109.84 112.67 41.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.341 0.591 . . . . 0.0 109.499 172.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -108.87 104.07 13.25 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.798 -177.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.74 -105.03 1.42 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.833 -0.699 . . . . 0.0 111.525 -177.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -117.21 5.06 12.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.737 0.303 . . . . 0.0 110.575 178.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.6 p -122.29 138.02 54.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.789 0.328 . . . . 0.0 111.392 -176.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.616 HG12 HG22 ' A' ' 89' ' ' VAL . 66.1 mt -90.53 137.52 21.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.848 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -134.38 178.86 6.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.808 0.337 . . . . 0.0 110.774 -176.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.589 HD11 ' O ' ' A' ' 56' ' ' LYS . 51.8 mt -123.49 110.61 26.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.354 -177.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.478 ' HG3' HG11 ' A' ' 88' ' ' VAL . 7.0 mm-40 -102.83 179.45 4.28 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.24 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -128.25 133.56 48.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.586 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.416 ' CZ ' ' HB2' ' A' ' 84' ' ' HIS . 52.1 p90 -115.91 140.59 49.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.007 174.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -56.82 127.11 30.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.906 178.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.2 t -52.71 122.31 26.4 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.792 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -63.02 -1.12 2.56 Favored 'Trans proline' 0 N--CA 1.476 0.494 0 C-N-CA 123.37 2.713 . . . . 0.0 113.432 -176.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.8 t -79.83 -44.3 23.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.412 175.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.513 ' HB3' ' CE2' ' A' ' 69' ' ' TYR . 14.7 ptmm? . . . . . 0 C--N 1.333 -0.139 0 CA-C-O 120.853 0.359 . . . . 0.0 110.874 -178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.423 ' OD2' ' HD2' ' A' ' 20' ' ' ARG . 16.2 t70 . . . . . 0 N--CA 1.466 0.338 0 CA-C-O 120.533 0.206 . . . . 0.0 111.278 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -53.74 -56.12 20.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.17 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -72.11 -30.64 65.28 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.208 -176.818 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 25.8 mmmt -67.56 -46.5 72.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.475 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.495 ' O ' ' HG2' ' A' ' 24' ' ' MET . 11.4 ptm180 -71.15 -26.59 63.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.0 tp -68.69 -48.82 62.93 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.973 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 11.6 pt-20 -70.77 -30.58 67.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.75 0.309 . . . . 0.0 110.59 175.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 7.6 tt0 -64.73 -53.89 40.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.697 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.495 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 12.0 ptp -61.79 -38.65 88.89 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.464 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 29' ' ' MET . 4.3 tppp? -56.15 -50.26 71.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.323 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.24 -49.93 75.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.635 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -52.01 -51.84 54.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.773 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.456 ' CG1' HG11 ' A' ' 34' ' ' VAL . 84.7 t -62.8 -34.42 65.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.326 -177.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.7 mmt -73.74 -8.93 57.92 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.452 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -102.94 -8.64 20.51 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -176.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -85.28 131.15 34.46 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.391 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.36 -42.06 98.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.152 -178.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -68.99 -45.4 70.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.018 0.437 . . . . 0.0 110.438 -175.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.456 HG11 ' CG1' ' A' ' 28' ' ' VAL . 44.7 t -56.85 -55.41 20.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.534 178.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -65.3 -31.64 72.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.799 0.333 . . . . 0.0 111.447 -176.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.2 -42.34 88.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.977 0.418 . . . . 0.0 110.526 174.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -65.75 -37.57 86.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.734 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.3 mm? -57.85 -44.89 86.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.242 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -24.21 40.89 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.77 0.319 . . . . 0.0 110.681 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.88 -49.89 73.07 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.313 0.578 . . . . 0.0 110.343 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -115.62 31.42 6.72 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.273 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.88 -23.41 65.16 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -175.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -85.13 -25.45 27.47 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.222 0.535 . . . . 0.0 110.661 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.4 t -96.12 -40.83 11.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.117 -174.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.7 mt -70.53 140.54 18.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.836 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.425 ' HB2' ' H ' ' A' ' 49' ' ' MET . 16.5 m-20 -91.92 151.02 20.72 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.53 176.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -61.4 -36.28 79.86 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -63.61 -43.06 98.0 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.321 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.425 ' H ' ' HB2' ' A' ' 46' ' ' ASP . 45.2 ttm -55.63 -37.87 68.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.9 178.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.6 mm -63.24 -49.11 84.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.866 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -58.47 -38.04 76.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.264 0.554 . . . . 0.0 110.777 178.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -77.68 -29.96 51.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.476 -176.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 m -106.06 11.68 31.21 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -174.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.8 tp -57.33 -38.1 73.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.867 0.365 . . . . 0.0 110.656 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -60.21 -39.43 86.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.089 177.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -69.9 -43.02 72.59 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.966 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.429 ' O ' HG23 ' A' ' 61' ' ' ILE . 10.8 mp -61.89 -40.63 96.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.351 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.48 ' O ' HG12 ' A' ' 61' ' ' ILE . 13.3 t80 -66.88 -44.17 81.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.993 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.11 -45.33 91.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.383 0.611 . . . . 0.0 110.064 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -58.79 -40.26 83.52 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.595 -178.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.52 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 23.4 pt -75.55 -30.11 21.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.551 -176.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -83.79 -22.76 31.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.785 0.326 . . . . 0.0 111.081 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -105.21 145.01 31.2 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -172.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.593 ' HB3' ' HG3' ' A' ' 85' ' ' PRO . 25.6 t 53.33 34.72 18.53 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 160.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.52 ' HE2' ' HA ' ' A' ' 61' ' ' ILE . 52.8 mmtt -63.02 -26.07 68.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.918 -0.489 . . . . 0.0 111.347 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -131.59 -166.95 1.79 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.042 0.448 . . . . 0.0 110.328 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.8 p -158.13 161.42 37.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.9 p -62.81 -26.68 68.86 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.221 0.534 . . . . 0.0 112.398 -171.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CE2' ' HA ' ' A' ' 104' ' ' LYS . 1.2 t80 -69.0 -16.66 63.78 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.753 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.467 ' HB3' HG21 ' A' ' 103' ' ' VAL . 25.8 p -124.8 5.71 8.1 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.81 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 m -137.16 152.72 50.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 179.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -82.03 -20.03 39.19 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.49 105.39 0.52 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.016 173.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -80.09 -13.39 59.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.223 0.535 . . . . 0.0 110.776 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -87.1 74.61 9.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.471 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 36.2 m -86.47 139.29 31.03 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.672 -176.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -92.26 37.7 0.99 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 171.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -115.26 138.2 51.2 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.176 -172.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.4 mp -80.14 -68.57 0.66 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.423 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.424 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 7.4 mp -85.49 100.83 12.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.876 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -63.68 139.5 58.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.125 0.488 . . . . 0.0 110.698 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.87 -8.69 79.0 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.454 -176.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.409 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 16.3 m-85 -121.96 168.87 11.4 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 122.248 0.219 . . . . 0.0 110.516 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -131.97 153.72 81.48 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.593 ' HG3' ' HB3' ' A' ' 64' ' ' SER . 93.9 Cg_endo -79.0 151.15 23.8 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.638 2.226 . . . . 0.0 112.085 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.408 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 61.9 tttp -147.85 137.36 22.44 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.645 176.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.402 HD23 HG12 ' A' ' 96' ' ' ILE . 90.9 mt -68.4 131.76 45.87 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.326 178.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 18.7 m -135.8 149.92 28.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.798 178.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.9 p -104.33 116.75 48.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.386 0.612 . . . . 0.0 110.765 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -112.91 99.0 7.54 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.445 176.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.75 -118.36 6.07 Favored Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.432 -175.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 34.8 mmt180 -111.12 14.17 21.85 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.922 0.392 . . . . 0.0 110.663 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.6 p -122.26 141.9 51.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.677 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 84.1 mt -97.53 130.21 46.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.962 0.411 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -118.12 175.3 5.75 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.427 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.402 HG12 HD23 ' A' ' 87' ' ' LEU . 58.1 mt -128.14 98.06 4.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.787 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -103.91 -175.86 2.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.718 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.424 ' CD2' ' HB2' ' A' ' 80' ' ' LEU . 9.1 m-85 -123.8 138.48 54.5 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -171.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.408 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 12.4 p90 -115.06 157.45 23.5 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 170.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -73.69 142.71 46.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.808 0.337 . . . . 0.0 111.613 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.7 t -60.55 122.77 70.27 Favored Pre-proline 0 C--N 1.333 -0.135 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.563 177.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -58.72 -17.03 33.76 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.995 2.463 . . . . 0.0 112.761 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.467 HG21 ' HB3' ' A' ' 70' ' ' CYS . 93.0 t -66.49 -16.85 21.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.953 175.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.462 ' HA ' ' CE2' ' A' ' 69' ' ' TYR . 36.7 ttpt . . . . . 0 C--N 1.33 -0.249 0 CA-C-O 121.313 0.578 . . . . 0.0 109.829 177.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.606 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 1.2 m-20 . . . . . 0 CA--C 1.523 -0.089 0 N-CA-C 111.536 0.198 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -59.83 -52.8 63.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 173.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.13 -33.24 69.91 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.606 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 45.1 mtpt -58.71 -44.23 90.31 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.218 176.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.448 ' O ' ' HG2' ' A' ' 24' ' ' MET . 18.0 tpp85 -69.45 -51.36 36.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.704 177.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.7 tp -58.07 -49.86 75.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.467 -175.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -76.94 -27.3 54.78 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 8.7 tt0 -63.12 -55.57 24.21 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 120.923 0.392 . . . . 0.0 110.077 175.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.632 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.9 ptm -61.84 -34.02 75.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.158 177.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.427 ' HE3' ' HB2' ' A' ' 25' ' ' LYS . 3.7 tppp? -55.29 -55.62 29.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.101 174.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.564 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 39.4 tt0 -62.68 -40.39 96.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.651 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.459 ' HE2' ' HB3' ' A' ' 27' ' ' LYS . 5.2 mmmm -52.39 -39.82 61.32 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.467 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.724 HG12 HG11 ' A' ' 34' ' ' VAL . 68.0 t -70.27 -39.01 76.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.11 -178.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 65.7 mtt -73.9 -4.81 37.32 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.532 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 27.3 mmtp -98.81 -5.82 30.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.738 0.304 . . . . 0.0 111.506 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -84.81 141.34 30.55 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.111 0.481 . . . . 0.0 111.201 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -69.94 -39.93 75.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.899 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -77.49 -42.15 36.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.902 0.382 . . . . 0.0 109.997 -174.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.724 HG11 HG12 ' A' ' 28' ' ' VAL . 40.0 t -54.57 -55.49 14.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.214 177.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.44 -32.56 74.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.755 0.312 . . . . 0.0 111.217 -177.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.69 -40.12 92.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.003 174.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -65.77 -40.45 92.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.608 176.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.82 HD11 HD11 ' A' ' 50' ' ' ILE . 2.0 mm? -57.54 -45.61 84.89 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.468 178.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -79.77 -20.46 46.22 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.926 0.394 . . . . 0.0 110.804 -178.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -68.4 -52.33 34.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.551 0.691 . . . . 0.0 109.966 176.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -106.86 29.97 6.55 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.329 -177.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -64.68 -16.08 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.283 0.563 . . . . 0.0 110.676 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.12 -19.89 59.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.579 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 39.8 t -119.37 -37.37 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.542 -173.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.8 mt -73.52 140.14 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.322 0.582 . . . . 0.0 111.919 -174.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.79 165.28 11.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.21 176.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -67.89 -36.99 81.2 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 172.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -57.69 -43.66 85.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.227 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 46.6 ttm -59.78 -37.17 78.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.851 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.82 HD11 HD11 ' A' ' 38' ' ' LEU . 38.6 mm -63.25 -54.89 27.25 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.174 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.8 mm-40 -50.83 -46.93 60.2 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 122.978 0.511 . . . . 0.0 111.459 176.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -68.74 -38.94 80.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.991 -177.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.418 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 5.6 m -101.67 17.38 23.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.342 0.592 . . . . 0.0 110.337 -176.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.479 HD23 HG22 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -65.36 -43.81 89.64 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.343 -174.658 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -57.54 -34.48 69.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.715 175.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.425 ' O ' HD11 ' A' ' 96' ' ' ILE . 66.5 mmtt -67.27 -53.65 28.01 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.903 0.382 . . . . 0.0 110.807 178.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.424 HD11 HG21 ' A' ' 94' ' ' ILE . 10.9 mp -62.72 -39.68 94.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.465 -177.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.429 ' O ' ' HG2' ' A' ' 62' ' ' GLU . 48.2 t80 -67.5 -41.24 84.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.986 0.422 . . . . 0.0 110.383 178.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 23.5 tt0 -62.54 -41.18 98.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.978 178.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -56.03 -52.81 62.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.832 178.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.6 pt -69.39 -29.86 43.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -174.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 58' ' ' TYR . 60.9 mm-40 -79.17 -17.04 55.69 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.923 0.392 . . . . 0.0 110.927 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 22.7 mt-30 -82.42 -175.3 5.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.423 0.63 . . . . 0.0 111.904 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.1 p -74.42 114.7 13.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.016 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -73.78 -27.53 61.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.912 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.482 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.0 t-20 -115.24 -170.64 1.8 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.03 -170.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.453 ' SG ' ' HB3' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -134.23 143.69 47.97 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.735 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 11.9 t -71.93 -11.5 60.82 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.256 -169.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.453 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 34.4 t80 -63.51 -31.75 73.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.917 175.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.482 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 32.1 p -114.64 -20.17 10.8 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.582 -0.447 . . . . 0.0 112.072 -173.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.5 p -113.42 142.85 45.4 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -112.51 24.55 12.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.525 0.678 . . . . 0.0 110.028 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.14 139.81 46.65 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.963 175.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -62.59 -24.03 67.34 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.937 -178.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -102.31 -1.39 31.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.669 -174.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 17.5 p -93.26 19.8 7.74 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.68 -174.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -71.84 96.35 1.64 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.425 0.631 . . . . 0.0 110.189 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -87.14 141.95 28.27 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.335 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.479 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.3 pt? -61.59 -40.56 95.21 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.055 0.455 . . . . 0.0 110.031 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 24.3 mt -86.32 158.36 19.68 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 172.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -140.48 131.16 25.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.483 0.658 . . . . 0.0 110.742 -170.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 80.69 6.08 89.58 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.893 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.436 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 77.2 m-85 -132.51 156.45 46.77 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 122.261 0.224 . . . . 0.0 110.533 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -126.95 150.6 72.29 Favored Pre-proline 0 N--CA 1.466 0.347 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 175.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.55 149.89 27.54 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 122.552 2.168 . . . . 0.0 112.408 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.1 pttt -147.34 160.1 42.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.118 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -87.2 138.54 31.4 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.538 HG11 ' OE1' ' A' ' 97' ' ' GLU . 18.1 m -133.5 150.39 32.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.554 178.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 p -102.46 120.7 52.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.47 0.652 . . . . 0.0 110.789 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -122.54 99.94 6.67 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.732 176.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.405 ' C ' ' HD2' ' A' ' 92' ' ' ARG . . . 67.66 -111.64 4.21 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.548 -176.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.429 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.3 mpt_? -114.4 15.82 17.89 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.187 0.518 . . . . 0.0 109.884 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.1 p -125.89 138.65 53.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.762 -178.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.424 HG21 HD11 ' A' ' 57' ' ' LEU . 67.4 mt -98.3 132.88 42.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 178.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -124.89 178.92 5.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -176.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.425 HD11 ' O ' ' A' ' 56' ' ' LYS . 50.2 mt -124.51 108.78 21.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.866 0.365 . . . . 0.0 110.59 -176.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.538 ' OE1' HG11 ' A' ' 88' ' ' VAL . 51.5 mt-10 -106.87 -178.14 3.56 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.134 177.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.436 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 4.5 m-85 -123.72 132.84 53.91 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.739 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -110.01 154.5 23.09 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -72.77 136.95 45.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.29 0.566 . . . . 0.0 110.848 -175.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 49.2 t -59.29 126.1 80.92 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.051 178.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 9.4 Cg_endo -55.7 -24.0 43.75 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.795 2.33 . . . . 0.0 111.984 176.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.0 t -81.44 -14.27 12.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.176 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 28.7 tptp . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.535 -173.346 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.3 t70 . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.91 0.386 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -65.58 -48.42 72.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.693 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.42 -31.67 70.16 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -179.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 52.1 mtpt -60.43 -50.11 74.88 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.987 175.027 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -63.95 -45.96 86.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.247 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.7 tp -58.06 -50.14 74.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.664 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 43.5 mm-40 -75.71 -26.97 58.02 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.4 tp-100 -57.98 -57.06 14.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.108 0.48 . . . . 0.0 109.713 174.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.505 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.8 ptm -65.65 -36.08 82.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.522 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 4.9 tppp? -54.01 -52.54 60.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.564 175.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.461 ' HA ' ' HG2' ' A' ' 29' ' ' MET . 38.2 tt0 -66.8 -43.56 83.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.866 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.3 mtpt -56.09 -41.86 75.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.639 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 24' ' ' MET . 73.7 t -64.44 -44.07 97.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.693 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.461 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 23.6 ptp -82.03 2.1 32.6 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.195 0.521 . . . . 0.0 110.765 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 13.9 tptt -94.74 -29.24 14.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.048 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -66.27 143.95 56.9 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.398 0.618 . . . . 0.0 111.538 -174.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -69.11 -47.14 65.93 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.444 -175.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -71.45 -42.8 67.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.798 -177.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.494 HG22 HD11 ' A' ' 87' ' ' LEU . 51.0 t -56.48 -54.6 26.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.758 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.4 HE21 ' HB3' ' A' ' 35' ' ' GLN . 2.5 pt20 -65.92 -30.71 71.33 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.383 -176.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.545 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . . . -62.52 -44.31 96.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.127 174.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.443 ' CE2' HD11 ' A' ' 45' ' ' ILE . 60.1 t80 -64.13 -39.62 94.42 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.676 177.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.603 HD11 HD11 ' A' ' 50' ' ' ILE . 2.6 mm? -58.37 -51.78 68.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.636 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.545 ' HE3' ' HA ' ' A' ' 36' ' ' ALA . 23.4 pttp -67.42 -28.16 67.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.023 0.439 . . . . 0.0 110.764 -177.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.81 -28.29 62.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.735 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -122.92 26.81 7.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.707 -174.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -66.52 -15.99 63.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.204 0.526 . . . . 0.0 110.968 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -70.9 -34.83 71.94 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.187 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 19.2 t -102.63 -39.56 6.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.366 -172.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.443 HD11 ' CE2' ' A' ' 37' ' ' PHE . 63.9 mt -75.96 138.46 20.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.069 -175.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.466 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -131.44 -177.72 4.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.905 -178.311 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -57.93 -41.47 82.8 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.758 0.313 . . . . 0.0 111.487 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -71.05 -42.04 69.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.58 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 45.9 tpp -56.26 -36.2 68.3 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.778 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.603 HD11 HD11 ' A' ' 38' ' ' LEU . 41.4 mm -63.94 -49.27 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.896 177.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -68.65 -37.85 79.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.853 -178.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -58.94 -48.47 81.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.158 0.504 . . . . 0.0 110.863 176.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.644 ' OG ' ' HB ' ' A' ' 94' ' ' ILE . 33.6 t -98.8 17.03 20.41 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.769 -173.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 41.4 tp -60.16 -38.15 82.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.794 0.33 . . . . 0.0 110.457 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -74.17 -35.7 64.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.204 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -66.63 -47.01 73.93 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.856 0.36 . . . . 0.0 110.811 177.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 53' ' ' SER . 95.1 mt -66.2 -39.07 89.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.632 -178.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -71.61 -37.89 70.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.241 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.675 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 31.2 tt0 -64.29 -36.81 85.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.186 0.517 . . . . 0.0 109.806 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.524 ' CE1' ' HB2' ' A' ' 85' ' ' PRO . 79.8 t80 -56.46 -51.15 69.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.184 176.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -74.9 -29.7 22.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -174.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.675 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 7.5 pt-20 -80.14 -13.07 59.55 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.167 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.532 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 45.6 mt-30 -85.63 -177.58 6.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.022 0.439 . . . . 0.0 110.54 174.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.1 t -87.47 105.15 17.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.311 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -69.4 -26.34 64.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.418 . . . . 0.0 109.991 175.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -83.0 -178.27 7.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.881 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 p -147.41 154.7 41.18 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.509 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 3.0 p -55.24 -33.48 63.16 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 124.239 0.962 . . . . 0.0 112.334 -174.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -62.54 -9.89 10.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.722 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.2 p -140.17 -0.79 1.61 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.466 ' OG ' ' HA ' ' A' ' 68' ' ' SER . 27.0 p -105.79 107.23 18.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.385 0.612 . . . . 0.0 111.307 -176.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -86.28 67.87 10.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.745 1.26 . . . . 0.0 109.255 176.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -153.79 156.97 38.69 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 113.006 -1.906 . . . . 0.0 108.435 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.64 -20.36 65.62 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 123.432 0.458 . . . . 0.0 111.563 -178.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -69.65 80.6 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.66 0.743 . . . . 0.0 111.2 177.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.509 ' SG ' ' HB3' ' A' ' 68' ' ' SER . 48.3 t -108.11 23.54 14.34 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.073 176.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -83.44 25.02 0.78 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.982 -174.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -80.14 139.35 36.86 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 174.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.431 ' HB3' HD12 ' A' ' 80' ' ' LEU . 3.0 tt -69.72 -65.19 0.75 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.961 0.41 . . . . 0.0 110.091 -177.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 79' ' ' LEU . 6.6 mp -85.64 122.14 29.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.94 0.4 . . . . 0.0 109.96 177.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -94.82 139.66 30.98 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.091 0.472 . . . . 0.0 110.196 178.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.35 -7.71 81.42 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.733 -178.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -121.27 164.2 17.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.456 0.169 . . . . 0.0 110.627 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.455 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 16.0 m170 -128.51 145.12 54.69 Favored Pre-proline 0 CA--C 1.515 -0.4 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.853 173.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.524 ' HB2' ' CE1' ' A' ' 60' ' ' TYR . 20.4 Cg_exo -64.0 135.55 48.23 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.516 2.144 . . . . 0.0 111.823 174.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.631 ' HG3' ' HB3' ' A' ' 97' ' ' GLU . 17.3 ptmt -134.21 146.74 50.4 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.175 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.494 HD11 HG22 ' A' ' 34' ' ' VAL . 98.1 mt -86.92 135.4 33.32 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 120.791 0.329 . . . . 0.0 110.705 -179.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 15.5 m -134.35 139.77 47.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.409 177.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.5 p -77.95 122.44 32.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 173.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -123.14 95.45 4.61 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.959 -171.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.449 ' C ' ' HD2' ' A' ' 92' ' ' ARG . . . 61.6 -106.97 1.31 Allowed Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.466 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.518 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 2.4 mpt_? -111.86 19.63 17.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.03 0.443 . . . . 0.0 110.958 -178.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 13.3 t -145.41 178.68 7.93 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.644 ' HB ' ' OG ' ' A' ' 53' ' ' SER . 75.5 mt -116.33 137.33 50.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 174.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -130.51 177.07 7.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.156 0.503 . . . . 0.0 110.953 -173.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 61.7 mt -118.8 122.62 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.852 -176.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.631 ' HB3' ' HG3' ' A' ' 86' ' ' LYS . 14.4 tt0 -107.74 -176.76 3.15 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.425 178.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.455 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 9.6 m-85 -137.45 134.76 36.19 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 110.529 -0.174 . . . . 0.0 110.529 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.45 ' CD2' ' HB3' ' A' ' 86' ' ' LYS . 53.4 p90 -117.61 160.83 20.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.215 176.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -72.55 126.03 28.87 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.379 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.428 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 43.4 t -51.01 123.04 18.36 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.523 174.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 9.2 Cg_endo -56.96 -18.7 29.12 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.306 2.671 . . . . 0.0 113.15 178.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.3 t -74.83 -13.01 15.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.148 0.499 . . . . 0.0 110.769 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 53.3 mmtt . . . . . 0 C--N 1.332 -0.195 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.819 173.97 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.533 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 30.9 t70 . . . . . 0 C--O 1.232 0.182 0 CA-C-O 121.245 0.545 . . . . 0.0 110.051 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.13 -49.83 72.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.909 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.92 -30.42 69.74 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 121.166 -0.214 . . . . 0.0 110.587 -178.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.533 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 48.8 mtmt -63.51 -50.11 70.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.96 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 20' ' ' ARG . 11.5 ptm180 -72.54 -28.05 62.6 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.769 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 35.3 tp -67.62 -49.98 60.34 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.858 0.361 . . . . 0.0 110.802 178.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -64.93 -32.66 74.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.419 176.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -62.33 -57.38 11.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.409 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.45 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.7 ptm -63.51 -39.04 93.38 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.792 -179.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.58 ' O ' ' HG2' ' A' ' 29' ' ' MET . 19.3 tptp -60.22 -48.85 79.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.457 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.405 ' O ' ' HB3' ' A' ' 30' ' ' LYS . 5.7 tp10 -54.08 -50.35 66.99 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.316 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.62 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 62.8 mtpt -54.86 -48.35 73.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.615 -176.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.563 ' HA ' HD13 ' A' ' 61' ' ' ILE . 91.3 t -64.63 -46.18 93.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.078 0.466 . . . . 0.0 111.112 -176.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.58 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.2 ptt? -88.08 5.99 38.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.442 0.639 . . . . 0.0 110.463 -171.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.653 ' HD2' ' N ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -102.81 -34.71 8.9 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.087 -0.961 . . . . 0.0 109.875 175.159 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.653 ' N ' ' HD2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -59.42 132.02 52.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.314 -172.523 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -62.9 -41.93 99.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.939 -172.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -60.1 -39.08 84.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.421 0.629 . . . . 0.0 110.207 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 97.5 t -65.27 -37.93 81.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.663 -179.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 70.9 mm-40 -58.76 -54.09 51.05 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.183 0.516 . . . . 0.0 110.766 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.24 -35.11 76.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.24 -176.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.506 ' CZ ' HG23 ' A' ' 89' ' ' VAL . 82.0 t80 -71.35 -42.4 68.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.714 178.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.757 HD11 HD11 ' A' ' 50' ' ' ILE . 1.1 mm? -59.31 -43.35 92.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.585 -179.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -79.14 -25.33 42.9 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.607 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -65.41 -54.75 24.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.304 0.573 . . . . 0.0 110.402 177.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -103.01 30.0 5.1 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.359 -174.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -60.46 -32.47 71.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -175.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -69.88 -28.99 66.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.238 0.542 . . . . 0.0 110.478 -177.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.2 t -97.54 -43.86 12.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.605 -176.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.729 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 66.2 mt -72.36 142.56 15.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.534 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -120.5 164.35 16.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.853 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -54.56 -45.0 73.4 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.305 0.574 . . . . 0.0 110.558 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -66.99 -35.83 80.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.616 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.729 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 23.0 ttt -59.91 -36.59 77.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.402 177.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.757 HD11 HD11 ' A' ' 38' ' ' LEU . 44.0 mm -62.74 -50.94 77.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.537 177.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.84 -39.31 93.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.634 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -60.95 -42.81 98.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.175 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.448 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.7 m -107.62 22.98 15.16 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.976 -175.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 25.6 tp -64.9 -26.33 68.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.01 0.433 . . . . 0.0 109.872 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -67.86 -41.23 83.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.166 176.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -67.71 -50.59 56.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.257 176.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 53' ' ' SER . 83.1 mt -58.19 -40.19 80.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.022 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -71.9 -45.88 59.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.29 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.553 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 40.7 tt0 -62.4 -34.79 77.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.369 0.604 . . . . 0.0 110.163 178.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -56.99 -53.27 59.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.295 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.563 HD13 ' HA ' ' A' ' 28' ' ' VAL . 41.9 pt -73.81 -30.6 28.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -174.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.553 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 8.7 pt-20 -78.74 -19.75 51.58 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 120.939 -0.305 . . . . 0.0 111.53 -177.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -73.2 -177.93 2.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.118 0.485 . . . . 0.0 110.964 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.583 ' HB2' ' HB2' ' A' ' 77' ' ' ASN . 13.7 t -71.42 114.17 9.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.217 -177.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -64.59 -44.66 89.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.004 -179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.425 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 2.3 m-20 -98.47 -163.45 1.04 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.916 177.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.4 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 4.9 p -148.58 157.09 43.22 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.449 ' OG ' ' HB3' ' A' ' 76' ' ' CYS . 2.6 m -62.23 -24.04 67.01 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.324 0.583 . . . . 0.0 111.188 -171.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -62.43 -20.06 64.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.255 177.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.3 p -128.07 -25.54 3.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -176.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.1 p -106.12 -171.91 1.99 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.732 0.301 . . . . 0.0 111.47 -175.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -107.63 17.36 22.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.432 -175.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -69.02 121.46 16.71 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.39 -40.15 27.04 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.043 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -101.97 85.18 2.64 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.102 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.449 ' HB3' ' OG ' ' A' ' 68' ' ' SER . 19.0 p -47.93 114.35 0.9 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.588 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . 0.583 ' HB2' ' HB2' ' A' ' 64' ' ' SER . 75.2 m-20 -87.35 -6.79 58.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.936 175.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.4 ' OD1' ' HA ' ' A' ' 67' ' ' CYS . 12.9 m120 -82.06 116.55 21.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.604 176.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.5 tp -61.09 -55.19 35.5 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.5 mp -86.93 87.72 7.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.566 172.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -72.06 148.97 45.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.023 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.54 -9.06 75.07 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 -171.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.437 ' CB ' ' HD2' ' A' ' 98' ' ' TYR . 74.9 m-85 -123.13 168.05 12.89 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.425 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 17.5 m170 -127.95 150.97 75.02 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 172.062 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.401 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 57.4 Cg_endo -74.35 142.5 30.15 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 122.09 1.86 . . . . 0.0 111.391 174.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.515 ' HB3' ' CE1' ' A' ' 99' ' ' TYR . 25.2 pttm -140.31 153.46 46.46 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.9 mt -84.92 142.82 29.4 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.624 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.1 m -136.2 148.63 27.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.077 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.529 HG22 ' HE1' ' A' ' 49' ' ' MET . 4.5 t -103.64 114.12 42.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.355 0.598 . . . . 0.0 110.263 176.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -114.43 96.17 5.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.647 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.82 -112.28 3.88 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.585 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -117.46 16.09 14.69 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.143 0.497 . . . . 0.0 110.278 176.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 15.3 m -124.18 136.95 54.55 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.147 177.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.455 HG12 HG22 ' A' ' 89' ' ' VAL . 58.2 mt -94.51 135.18 29.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.56 178.61 6.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.077 0.465 . . . . 0.0 110.799 -173.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 69.3 mt -118.94 130.26 74.01 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.291 -176.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.401 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 0.0 OUTLIER -126.06 176.38 7.06 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.352 -177.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.437 ' HD2' ' CB ' ' A' ' 83' ' ' TYR . 5.0 m-85 -128.71 149.94 50.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.767 0.318 . . . . 0.0 110.736 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.515 ' CE1' ' HB3' ' A' ' 86' ' ' LYS . 51.3 p90 -139.95 152.54 46.42 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.426 ' HG3' ' CE2' ' A' ' 83' ' ' TYR . 2.5 mp0 -61.27 134.2 56.71 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.982 0.42 . . . . 0.0 111.236 -178.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.6 t -53.38 123.21 35.02 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.448 175.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.77 -25.52 79.48 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.829 2.352 . . . . 0.0 112.176 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 50.8 t -67.81 -19.95 25.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.871 179.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 62.4 tttp . . . . . 0 C--N 1.33 -0.248 0 CA-C-O 121.391 0.615 . . . . 0.0 109.882 178.168 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.618 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 2.4 p-10 . . . . . 0 CA--C 1.52 -0.206 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -49.6 -49.58 46.2 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.457 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.09 -33.26 75.37 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.681 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 26.0 mmtp -73.55 -29.44 62.44 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.618 ' HG2' ' O ' ' A' ' 16' ' ' ASP . 13.7 mmm-85 -68.37 -46.47 69.99 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 172.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.7 tp -55.57 -48.88 74.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.116 177.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -65.56 -39.14 91.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.017 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.52 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.9 tp-100 -63.76 -52.1 61.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.764 -177.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.518 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.8 ptm -66.63 -38.28 86.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.48 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -59.46 -44.22 93.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.178 0.513 . . . . 0.0 109.931 177.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.466 ' HA ' ' HG2' ' A' ' 29' ' ' MET . 33.1 tt0 -67.07 -44.41 80.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.318 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -52.29 -51.01 61.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.215 177.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 24' ' ' MET . 85.5 t -59.06 -41.82 84.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.944 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.466 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 21.7 ptp -85.52 14.91 4.99 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -176.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.414 ' HD3' ' HG2' ' A' ' 26' ' ' GLU . 3.6 mptp? -119.45 -2.33 10.58 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 176.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.681 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 29.6 t70 -85.3 135.11 34.05 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.617 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.52 ' HG3' ' N ' ' A' ' 33' ' ' ASP . 5.1 pt20 -63.34 -41.16 98.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.073 -176.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.52 ' N ' ' HG3' ' A' ' 32' ' ' GLN . 11.9 m-20 -74.12 -33.1 63.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.022 0.439 . . . . 0.0 110.001 -175.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.13 -43.9 93.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.047 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.681 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 71.2 mm-40 -56.44 -50.32 72.02 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.269 0.557 . . . . 0.0 110.496 177.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -56.9 -45.66 82.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.424 -178.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -67.34 -41.35 85.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.136 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.456 HD11 HD11 ' A' ' 50' ' ' ILE . 1.9 mm? -57.82 -43.83 86.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.449 -178.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.544 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.6 ptmm? -82.8 -22.04 34.33 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.753 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 1.1 tm-20 -65.92 -39.56 90.66 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -116.81 32.48 6.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.843 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.544 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 10.7 pt-20 -61.43 -22.5 65.08 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.073 0.463 . . . . 0.0 111.181 -178.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -77.62 -34.63 53.29 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 177.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.3 t -93.29 -39.36 10.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.394 -171.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.532 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 76.1 mt -71.61 142.97 14.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.24 0.543 . . . . 0.0 111.434 -174.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -120.81 166.02 14.34 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.031 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 57.4 mt-30 -57.69 -44.17 85.63 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.241 0.543 . . . . 0.0 109.963 174.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -63.71 -38.33 90.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.029 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.532 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 50.7 ttm -57.01 -39.16 74.19 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.255 177.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.456 HD11 HD11 ' A' ' 38' ' ' LEU . 45.7 mm -67.27 -42.06 87.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.879 178.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 42.7 mm-40 -66.88 -43.28 83.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.129 0.49 . . . . 0.0 110.417 -178.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -67.57 -30.24 69.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.3 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.501 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.5 m -109.0 19.1 19.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.262 -175.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 mt -59.76 -46.6 88.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.053 0.454 . . . . 0.0 110.427 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -57.73 -39.84 78.24 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.856 176.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.576 ' O ' HD11 ' A' ' 96' ' ' ILE . 4.9 mmpt? -67.66 -51.05 54.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.139 0.495 . . . . 0.0 110.283 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 53' ' ' SER . 90.3 mt -62.24 -41.65 98.61 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.127 -177.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -69.49 -43.97 72.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.414 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.574 ' HG3' ' NE2' ' A' ' 63' ' ' GLN . 11.1 tp10 -56.44 -39.38 73.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.135 0.493 . . . . 0.0 109.892 175.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.442 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 56.2 t80 -56.52 -52.61 64.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.917 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.54 ' HA ' ' HD3' ' A' ' 65' ' ' LYS . 32.9 pt -75.53 -30.57 22.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -77.61 -19.62 55.25 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 111.283 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.574 ' NE2' ' HG3' ' A' ' 59' ' ' GLU . 46.0 mt-30 -78.79 -171.54 2.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.163 0.506 . . . . 0.0 110.756 175.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.2 p -75.64 99.74 4.41 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.423 178.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.54 ' HD3' ' HA ' ' A' ' 61' ' ' ILE . 12.3 mmmm -63.78 -26.49 68.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.206 0.527 . . . . 0.0 110.265 176.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.539 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.5 t-20 -112.63 -165.65 1.01 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.568 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -148.09 154.53 40.33 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.902 178.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.657 ' HA ' ' O ' ' A' ' 71' ' ' SER . 25.6 t -67.78 -20.62 65.22 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.236 -175.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.416 ' HB2' ' HA2' ' A' ' 82' ' ' GLY . 8.2 t80 -69.44 -13.67 62.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 111.601 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.539 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 24.6 p -123.33 -33.69 3.22 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.696 -0.401 . . . . 0.0 110.534 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.657 ' O ' ' HA ' ' A' ' 68' ' ' SER . 39.5 m -125.29 103.79 8.13 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -85.66 61.24 6.73 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.904 0.859 . . . . 0.0 110.614 -173.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -85.37 139.42 31.58 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.511 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -86.54 -21.76 26.73 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.656 -174.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -90.28 -34.02 15.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.694 0.283 . . . . 0.0 111.228 -174.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.67 120.41 11.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.109 0.481 . . . . 0.0 111.496 -178.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -77.64 92.89 4.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.551 ' OD1' ' HA ' ' A' ' 81' ' ' GLU . 2.4 t-20 -100.43 117.9 35.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.715 178.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.1 mt -74.06 -74.46 0.19 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.466 -176.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.0 mp -85.57 96.78 9.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 174.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.619 ' HG3' ' HB3' ' A' ' 68' ' ' SER . 30.7 tt0 -72.62 124.71 25.82 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.176 0.512 . . . . 0.0 110.173 -177.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.416 ' HA2' ' HB2' ' A' ' 69' ' ' TYR . . . 103.88 -7.74 49.45 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.333 -176.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.576 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 15.5 m-85 -121.37 162.01 21.12 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 178.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.0 m170 -124.68 150.88 66.69 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 173.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.435 ' HB2' ' CD1' ' A' ' 60' ' ' TYR . 55.5 Cg_endo -71.39 141.44 38.81 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.672 2.248 . . . . 0.0 111.536 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.611 ' HB2' ' CD1' ' A' ' 99' ' ' TYR . 86.4 tttt -131.47 131.14 43.27 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.568 -172.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.476 HD12 ' HA ' ' A' ' 87' ' ' LEU . 0.4 OUTLIER -85.76 125.98 33.65 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.254 177.429 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.619 HG11 ' HG3' ' A' ' 97' ' ' GLU . 29.5 m -131.26 145.21 35.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.668 0.271 . . . . 0.0 110.882 178.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.4 p -95.52 120.42 44.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.259 0.552 . . . . 0.0 110.024 176.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -121.96 96.3 5.0 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.866 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.65 -104.31 1.59 Allowed Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.151 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -116.57 5.71 13.34 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.565 0.221 . . . . 0.0 111.175 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.1 p -130.01 159.86 35.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.975 0.417 . . . . 0.0 111.35 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.9 mt -110.28 137.9 40.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.92 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.508 ' HA ' ' HD3' ' A' ' 56' ' ' LYS . 1.8 t0 -126.97 178.92 5.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.879 0.371 . . . . 0.0 110.63 -175.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.576 HD11 ' O ' ' A' ' 56' ' ' LYS . 44.8 mt -123.1 112.61 34.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.195 -176.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.619 ' HG3' HG11 ' A' ' 88' ' ' VAL . 3.7 mm-40 -98.61 -175.11 2.98 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.272 174.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.576 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 3.3 m-85 -139.67 124.03 18.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 174.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.611 ' CD1' ' HB2' ' A' ' 86' ' ' LYS . 39.0 p90 -110.41 147.02 34.85 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 176.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.538 ' H ' ' CD ' ' A' ' 100' ' ' GLU . 2.3 pm0 -66.44 135.06 53.73 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.478 0.656 . . . . 0.0 110.713 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.457 ' SG ' HG12 ' A' ' 103' ' ' VAL . 21.3 t -44.52 124.67 4.75 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 114.195 -1.366 . . . . 0.0 111.857 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -59.32 -10.23 10.34 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 123.339 2.693 . . . . 0.0 113.435 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.457 HG12 ' SG ' ' A' ' 101' ' ' CYS . 8.7 p -66.57 -18.33 23.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.035 0.445 . . . . 0.0 110.625 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.412 ' HD2' ' HA ' ' A' ' 104' ' ' LYS . 13.1 mmmm . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.894 176.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.426 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 11.4 m-20 . . . . . 0 CA--C 1.522 -0.131 0 CA-C-O 120.478 0.18 . . . . 0.0 111.263 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.81 -51.71 67.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.142 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.42 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -70.66 -31.18 68.01 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.313 -177.79 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.462 ' HE3' ' HB3' ' A' ' 19' ' ' LYS . 21.1 mtpp -66.59 -48.77 68.49 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.966 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.506 ' O ' ' HG2' ' A' ' 24' ' ' MET . 7.2 ptm180 -68.47 -31.69 71.16 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 37.2 tp -62.86 -50.28 71.53 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -59.66 -45.13 92.95 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 120.952 0.406 . . . . 0.0 110.31 176.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -59.1 -57.76 11.62 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.385 -175.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.506 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 25.3 ptm -66.74 -38.3 86.39 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.39 -177.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 25' ' ' LYS . 17.0 tptm -64.81 -41.46 95.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.004 0.431 . . . . 0.0 110.292 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.526 ' HG3' ' HD3' ' A' ' 30' ' ' LYS . 23.4 tt0 -61.83 -50.63 71.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.557 177.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -54.41 -42.27 70.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.303 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 24' ' ' MET . 87.0 t -68.87 -42.75 82.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.968 0.413 . . . . 0.0 110.953 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 44.4 mtt -78.69 -6.93 57.09 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -175.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.526 ' HD3' ' HG3' ' A' ' 26' ' ' GLU . 2.1 mptm? -103.26 -4.08 24.78 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -178.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.703 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 25.2 t70 -83.41 134.0 34.9 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.843 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -66.25 -41.34 90.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.851 -175.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -74.32 -35.49 63.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.776 0.322 . . . . 0.0 110.393 -174.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.8 t -55.67 -47.65 78.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.774 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.703 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 35.1 mt-30 -65.02 -31.75 73.13 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.155 0.502 . . . . 0.0 110.88 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.34 -46.49 88.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.464 176.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -65.52 -42.35 92.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.407 176.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.434 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.8 mm? -57.36 -44.43 84.35 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.703 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -73.75 -28.18 61.55 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.923 -177.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -66.47 -55.71 14.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.619 0.723 . . . . 0.0 110.474 178.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -102.47 30.23 4.74 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.627 -174.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -60.4 -27.41 67.43 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.124 -177.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -85.79 -24.1 26.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.885 0.374 . . . . 0.0 111.122 -179.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 22.0 t -93.4 -35.15 6.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.277 0.56 . . . . 0.0 111.147 -172.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.48 HG23 ' HE2' ' A' ' 49' ' ' MET . 50.7 mt -88.27 150.99 3.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.522 -178.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -119.34 163.2 17.53 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 29.9 mm-40 -59.61 -39.06 82.98 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.606 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -64.52 -38.05 89.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.045 0.45 . . . . 0.0 110.554 178.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.48 ' HE2' HG23 ' A' ' 45' ' ' ILE . 2.1 ttp -67.43 -31.93 72.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.224 178.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.0 mm -63.69 -46.39 94.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.256 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 9.7 mm-40 -67.37 -40.46 85.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.74 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -66.68 -43.52 84.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.02 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.401 ' HB2' HD12 ' A' ' 94' ' ' ILE . 50.6 m -98.98 19.31 15.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.002 -178.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 42.8 tp -63.06 -30.12 71.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -61.83 -38.08 86.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.02 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 17.1 mmtm -74.95 -40.64 60.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.321 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.09 -41.06 97.8 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.331 0.586 . . . . 0.0 110.167 175.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -69.62 -44.47 70.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.539 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.56 ' HG2' ' NE2' ' A' ' 63' ' ' GLN . 45.3 tt0 -64.13 -35.4 80.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.344 178.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.541 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 26.3 t80 -56.15 -56.1 25.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.369 177.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.1 pt -69.31 -30.99 47.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.09 -174.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 11.0 pt-20 -80.53 -24.97 38.95 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.142 -0.623 . . . . 0.0 112.241 -174.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.56 ' NE2' ' HG2' ' A' ' 59' ' ' GLU . 49.7 mt-30 -77.76 -32.4 52.6 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.833 -176.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.455 ' OG ' ' HB2' ' A' ' 78' ' ' ASN . 10.9 m -178.84 118.37 0.07 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.047 -175.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.71 -51.79 6.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.8 0.81 . . . . 0.0 109.088 169.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.533 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 30.7 p30 -115.71 -157.81 0.66 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.948 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.482 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 8.2 p -152.62 163.55 39.41 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 44.4 t -54.92 -31.13 59.94 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 123.829 0.706 . . . . 0.0 111.286 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.458 ' HB2' ' HA2' ' A' ' 82' ' ' GLY . 0.1 OUTLIER -75.36 4.97 6.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.286 -0.416 . . . . 0.0 112.036 -178.656 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 66' ' ' ASN . 31.9 p -151.64 19.25 0.71 Allowed 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.141 0.496 . . . . 0.0 110.352 175.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.6 t -129.65 153.38 48.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.414 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.5 tp10 -77.44 -27.1 52.05 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -84.6 129.25 34.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.349 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.96 -4.86 5.06 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.564 174.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -75.51 -40.56 56.93 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.209 -175.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 26.4 p -152.07 26.18 0.62 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.866 0.365 . . . . 0.0 110.934 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -68.89 -60.44 2.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.253 -173.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.482 ' OD1' ' HA ' ' A' ' 67' ' ' CYS . 1.3 p-10 -160.97 156.98 25.61 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.28 -0.418 . . . . 0.0 109.928 -177.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -74.06 -56.81 4.48 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.789 0.328 . . . . 0.0 111.161 -174.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 29.1 mt -82.29 81.25 8.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.43 0.633 . . . . 0.0 111.058 -176.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -64.59 129.34 39.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.767 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . 0.458 ' HA2' ' HB2' ' A' ' 69' ' ' TYR . . . 97.52 -9.02 64.47 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.346 178.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.73 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 44.7 m-85 -125.0 157.93 34.94 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 111.394 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.533 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 12.5 m170 -129.61 155.29 80.51 Favored Pre-proline 0 CA--C 1.51 -0.59 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 171.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.541 ' O ' ' HE1' ' A' ' 60' ' ' TYR . 38.2 Cg_endo -77.81 151.61 28.17 Favored 'Trans proline' 0 N--CA 1.446 -1.318 0 C-N-CA 122.096 1.864 . . . . 0.0 110.717 172.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 31.5 ttpt -144.83 141.35 29.07 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 176.274 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.466 HD22 ' H ' ' A' ' 87' ' ' LEU . 1.8 mm? -78.7 140.01 38.4 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 32.2 m -132.26 147.84 32.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 175.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 p -98.17 114.4 35.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.406 0.622 . . . . 0.0 110.298 178.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -117.42 96.32 5.35 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.556 178.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.83 -107.38 2.07 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.066 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -116.96 19.16 14.46 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.218 0.533 . . . . 0.0 110.482 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.8 p -135.42 141.77 45.5 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.234 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.401 HD12 ' HB2' ' A' ' 53' ' ' SER . 68.1 mt -96.54 131.84 42.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.116 178.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -120.48 178.13 4.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.636 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 70.8 mt -132.93 114.53 22.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.851 0.357 . . . . 0.0 110.934 -176.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 9.4 pt-20 -103.13 -177.05 3.26 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.73 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 2.9 m-85 -130.25 123.61 30.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.107 0.48 . . . . 0.0 110.587 175.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.467 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 51.2 p90 -112.75 151.88 29.77 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 176.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.412 ' HA ' ' HA ' ' A' ' 83' ' ' TYR . 5.4 pt-20 -84.42 133.26 34.51 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.744 0.783 . . . . 0.0 111.467 -178.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 6.6 t -46.8 123.49 7.65 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.803 -178.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.93 -10.79 29.7 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.801 2.334 . . . . 0.0 112.442 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 59.6 t -69.0 -20.44 24.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.925 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 101' ' ' CYS . 22.3 ptmt . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.683 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 120.682 0.277 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -54.58 -56.16 21.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.685 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.531 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 2.9 pt20 -71.5 -30.29 65.79 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.733 -177.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 29.9 mtpp -59.01 -47.92 83.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.533 178.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.403 ' HD3' HH11 ' A' ' 20' ' ' ARG . 19.7 ptt180 -77.49 -29.98 52.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.694 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.531 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 23.5 tp -61.1 -50.02 74.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.899 179.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 21.8 mm-40 -75.68 -27.2 58.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.097 178.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 34.1 tt0 -62.25 -54.87 34.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.931 0.396 . . . . 0.0 110.551 178.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.499 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.3 ptm -65.67 -36.99 85.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.025 177.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.422 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 11.7 tptm -54.3 -49.33 69.91 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.695 175.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -60.14 -48.3 82.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.996 -175.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -57.34 -40.3 77.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.111 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 24' ' ' MET . 60.7 t -70.96 -33.89 53.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.168 0.509 . . . . 0.0 110.393 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.5 mmt -71.03 -14.01 62.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.125 -176.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.77 14.51 12.56 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.693 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 18.3 t70 -85.31 135.48 33.89 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.549 176.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -63.99 -47.31 80.84 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.83 -175.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -70.48 -34.04 71.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.893 0.377 . . . . 0.0 110.405 -175.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 76.4 t -58.59 -43.23 86.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.761 174.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.693 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 61.9 mm-40 -59.59 -49.06 79.22 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.171 0.51 . . . . 0.0 110.527 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.52 -43.48 75.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.609 -177.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.505 ' CE2' HD11 ' A' ' 45' ' ' ILE . 78.3 t80 -72.28 -40.98 67.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.057 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.92 HD11 HD11 ' A' ' 50' ' ' ILE . 1.9 mm? -60.11 -45.54 92.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.538 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -73.71 -26.15 60.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.536 -178.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -66.35 -54.92 18.97 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.384 0.612 . . . . 0.0 110.307 176.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -105.69 32.64 4.2 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.483 -173.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -62.43 -24.45 67.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.944 0.402 . . . . 0.0 111.178 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -68.5 -36.42 78.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.336 0.588 . . . . 0.0 110.011 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 15.4 t -93.9 -43.21 13.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.83 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.505 HD11 ' CE2' ' A' ' 37' ' ' PHE . 67.9 mt -75.63 144.21 12.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.864 -176.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -131.25 176.72 8.04 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.413 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 99.3 mt-30 -59.74 -39.93 86.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.763 0.316 . . . . 0.0 111.82 -177.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -72.8 -36.8 67.66 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.935 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.484 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 53.6 ttm -56.47 -36.58 69.25 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 174.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.92 HD11 HD11 ' A' ' 38' ' ' LEU . 37.2 mm -61.48 -54.71 31.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.996 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.734 ' HA ' HD23 ' A' ' 54' ' ' LEU . 29.7 mt-10 -68.82 -34.6 75.78 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -178.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.4 tptp -65.02 -26.54 68.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.906 0.384 . . . . 0.0 110.525 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -115.2 16.36 16.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.38 -178.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.734 HD23 ' HA ' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -58.83 -41.16 86.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.613 -178.685 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -55.48 -43.77 75.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.436 176.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.505 ' O ' HD11 ' A' ' 96' ' ' ILE . 33.2 mmtp -71.49 -48.38 49.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.861 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.57 -42.26 87.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.034 0.445 . . . . 0.0 110.753 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -70.08 -39.44 75.59 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.423 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.01 -40.13 92.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.038 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.457 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 70.0 t80 -63.25 -50.49 69.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.979 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.1 pt -70.28 -31.27 46.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -171.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -85.38 -25.67 26.92 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.335 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.457 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 0.8 OUTLIER -75.06 160.99 29.83 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.603 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.9 p -64.1 120.52 12.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.696 0.284 . . . . 0.0 111.39 -176.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HD3' ' O ' ' A' ' 65' ' ' LYS . 3.0 tmtp? -73.64 -31.74 63.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.526 0.679 . . . . 0.0 109.168 177.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -84.73 -165.4 1.17 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.215 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 p -157.8 159.85 37.17 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 176.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.446 ' HB2' ' HB2' ' A' ' 76' ' ' CYS . 22.8 t -67.42 -23.43 65.55 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.054 0.454 . . . . 0.0 110.509 -172.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -68.1 -9.09 43.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.696 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.2 p -133.42 1.24 3.42 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 28.8 m -122.64 140.51 52.75 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -81.09 57.3 3.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.928 0.87 . . . . 0.0 110.407 -177.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -154.32 124.71 6.95 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.231 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -100.35 0.16 39.47 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.357 -176.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -88.45 53.24 2.66 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.467 ' SG ' ' HB3' ' A' ' 78' ' ' ASN . 49.7 t -84.55 129.98 34.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.59 -1.187 . . . . 0.0 111.154 -172.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -80.13 -17.42 52.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.001 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.467 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 39.0 t30 -57.97 136.86 57.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.508 -177.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.7 mt -81.86 -56.52 3.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.859 -179.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.417 ' HB2' ' CE2' ' A' ' 98' ' ' TYR . 3.9 mm? -85.34 79.36 9.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.715 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -73.5 138.71 45.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.562 0.696 . . . . 0.0 110.67 -176.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.55 -8.58 68.91 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.956 -171.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.462 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 74.4 m-85 -122.78 168.91 11.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 178.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.415 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 15.7 m170 -128.41 149.12 70.69 Favored Pre-proline 0 C--O 1.236 0.383 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 170.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -70.74 142.67 44.14 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.78 2.32 . . . . 0.0 112.866 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.484 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 16.6 ttmm -133.48 137.19 45.55 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.179 177.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.1 mt -83.66 130.63 34.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.198 176.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.425 HG21 ' HG2' ' A' ' 97' ' ' GLU . 16.0 m -132.11 149.86 33.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.48 178.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.6 p -97.64 118.03 43.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.201 0.524 . . . . 0.0 110.697 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -122.31 98.04 5.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.014 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.53 -112.01 4.58 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.995 -177.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.46 ' HD3' ' HE2' ' A' ' 49' ' ' MET . 17.7 mmt180 -112.6 15.49 20.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.155 0.503 . . . . 0.0 110.512 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.9 p -125.78 131.12 52.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.075 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.5 mt -91.04 129.16 42.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -119.27 177.83 4.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.952 0.406 . . . . 0.0 110.847 -170.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.505 HD11 ' O ' ' A' ' 56' ' ' LYS . 56.5 mt -127.7 106.87 15.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.587 -177.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.425 ' HG2' HG21 ' A' ' 88' ' ' VAL . 57.3 mm-40 -97.31 178.9 5.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.433 176.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 80' ' ' LEU . 24.4 m-85 -132.16 130.71 41.45 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.159 0.504 . . . . 0.0 111.12 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.484 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 38.0 p90 -113.41 150.87 32.1 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.381 174.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.462 ' HG2' ' CE1' ' A' ' 83' ' ' TYR . 36.8 mt-10 -64.62 131.48 47.1 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.657 0.265 . . . . 0.0 110.907 -177.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.518 ' SG ' HG12 ' A' ' 103' ' ' VAL . 47.7 t -44.63 122.56 4.54 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.889 177.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.53 -12.67 21.82 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 123.241 2.627 . . . . 0.0 113.849 -175.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.518 HG12 ' SG ' ' A' ' 101' ' ' CYS . 4.5 p -67.77 -19.02 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 120.765 0.316 . . . . 0.0 110.525 178.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.2 mttt . . . . . 0 C--O 1.231 0.109 0 CA-C-O 121.068 0.461 . . . . 0.0 110.515 177.19 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.55 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 2.1 p-10 . . . . . 0 C--O 1.232 0.165 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -55.48 -53.06 61.06 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.539 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.404 HE21 ' HB2' ' A' ' 18' ' ' GLN . 2.0 pt20 -63.66 -31.23 72.33 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.888 -177.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.55 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 43.1 mtmt -64.36 -36.67 84.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.576 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.466 ' O ' ' HG2' ' A' ' 24' ' ' MET . 8.6 mtt180 -71.77 -50.65 28.05 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.8 tp -54.21 -49.64 68.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.049 -175.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -74.67 -34.58 62.71 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.97 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 8.2 tt0 -63.44 -56.19 18.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.777 0.323 . . . . 0.0 110.862 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.608 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.4 ptm -61.7 -37.64 84.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.747 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.551 ' HA ' ' HE3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -66.93 -44.55 80.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.154 178.707 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -65.03 -37.21 86.86 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -58.06 -44.16 87.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.698 175.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 24' ' ' MET . 78.1 t -64.62 -36.08 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.956 178.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.456 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 88.9 mmm -84.97 0.14 52.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.071 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.87 -35.99 13.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.436 0.636 . . . . 0.0 110.331 175.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.692 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 21.7 t70 -62.56 123.49 18.48 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.154 -171.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.439 ' H ' ' CD ' ' A' ' 32' ' ' GLN . 1.0 OUTLIER -60.65 -41.25 94.6 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.395 -176.547 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -63.12 -46.85 85.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.918 -177.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.8 t -54.93 -47.11 76.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.404 176.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.692 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 55.5 mt-30 -62.31 -40.63 96.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.5 -176.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.54 -40.26 82.49 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.562 177.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.459 ' CE2' HD11 ' A' ' 45' ' ' ILE . 88.5 t80 -69.56 -39.79 77.18 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.397 177.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.579 HD11 HD11 ' A' ' 50' ' ' ILE . 2.6 mm? -63.08 -44.91 94.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.756 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -68.51 -29.12 67.65 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.104 0.478 . . . . 0.0 110.527 -177.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.47 -30.42 37.43 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.987 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -119.14 26.55 9.41 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -65.4 -17.64 64.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.097 0.475 . . . . 0.0 110.18 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.84 -31.76 69.81 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.118 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.5 t -108.19 -35.43 2.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.492 -172.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.459 HD11 ' CE2' ' A' ' 37' ' ' PHE . 68.9 mt -78.3 135.67 25.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.558 0.694 . . . . 0.0 111.516 -175.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -111.44 164.98 12.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.74 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.401 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 76.7 mt-30 -61.51 -37.23 82.94 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.347 0.594 . . . . 0.0 109.658 173.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -63.07 -42.2 99.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.276 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 33.6 tpp -56.21 -42.29 76.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.289 176.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.579 HD11 HD11 ' A' ' 38' ' ' LEU . 35.9 mm -60.32 -39.35 80.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.517 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.516 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 41.8 mt-10 -65.58 -49.19 69.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.487 176.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -60.65 -47.16 87.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.14 -177.027 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.3 p -92.79 17.66 10.1 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.329 -175.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.516 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -52.45 -49.37 64.76 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.96 0.409 . . . . 0.0 110.786 -179.473 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -61.74 -42.32 98.81 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.681 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -61.15 -51.36 69.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.806 0.336 . . . . 0.0 110.388 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 57' ' ' LEU . 3.9 mm? -59.95 -43.31 95.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.054 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -66.21 -42.62 88.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.411 -177.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -59.59 -36.43 76.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.352 0.596 . . . . 0.0 110.021 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -67.23 -45.38 76.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.885 -178.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.6 pt -75.36 -31.4 23.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -174.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -81.07 -27.05 35.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.589 0.233 . . . . 0.0 111.29 -177.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -80.25 173.99 12.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.055 0.455 . . . . 0.0 111.117 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.6 m -76.7 116.04 17.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.704 -179.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -81.02 -35.76 31.47 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.129 0.49 . . . . 0.0 110.111 176.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -79.86 -177.02 5.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.952 177.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -150.79 156.81 42.02 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.632 -177.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.492 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 33.1 t -66.98 -19.01 65.65 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.223 -172.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.483 ' CE1' ' HA ' ' A' ' 104' ' ' LYS . 1.2 t80 -75.9 -2.23 29.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.066 0.46 . . . . 0.0 111.305 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 17.6 p -132.24 -44.28 0.94 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.559 176.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.6 p -80.53 152.09 28.84 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -81.97 -9.79 59.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.818 0.342 . . . . 0.0 110.768 -176.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . 0.482 ' HB2' ' HB2' ' A' ' 76' ' ' CYS . 7.4 m-20 -55.0 111.82 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.222 -175.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -70.4 -21.74 62.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.449 0.643 . . . . 0.0 109.273 171.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -86.98 4.84 40.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.563 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . 0.482 ' HB2' ' HB2' ' A' ' 73' ' ' ASP . 45.8 t -69.3 114.37 7.48 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.07 0.462 . . . . 0.0 110.506 -178.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -117.22 143.85 45.43 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -160.49 168.41 25.15 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.0 mt -75.26 -79.22 0.1 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 8.0 mp -88.34 93.86 9.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.206 173.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.492 ' CD ' ' H ' ' A' ' 68' ' ' SER . 2.2 mm-40 -76.19 151.52 36.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.354 0.597 . . . . 0.0 110.714 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.38 -9.74 72.01 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.028 -170.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.559 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 64.9 m-85 -122.47 172.12 8.59 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.491 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 14.5 m170 -128.92 144.35 52.19 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 172.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -75.34 130.76 13.22 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.446 2.097 . . . . 0.0 111.252 174.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.557 ' HD3' ' CD1' ' A' ' 99' ' ' TYR . 19.9 pttp -134.99 148.5 49.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.007 0.432 . . . . 0.0 109.994 175.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.415 HD23 HG12 ' A' ' 96' ' ' ILE . 73.2 mt -81.26 141.62 33.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.346 -175.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.7 m -135.95 154.23 33.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.562 175.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.6 p -107.05 114.02 45.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.343 0.592 . . . . 0.0 110.346 176.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -125.89 101.97 7.07 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.302 -177.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.73 -118.5 9.86 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.211 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 92' ' ' ARG . 20.7 tpp180 -105.2 19.52 20.45 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.978 0.894 . . . . 0.0 109.947 -179.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 43.3 t -136.16 136.53 40.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.25 0.548 . . . . 0.0 111.433 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 86.3 mt -89.61 119.54 36.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 169.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.57 177.71 4.54 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.852 0.358 . . . . 0.0 110.634 -172.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.415 HG12 HD23 ' A' ' 87' ' ' LEU . 53.3 mt -131.64 115.98 29.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.309 -177.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -119.03 163.28 17.21 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 174.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.559 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 30.3 m-85 -103.92 141.21 36.55 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.096 -176.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.557 ' CD1' ' HD3' ' A' ' 86' ' ' LYS . 53.6 p90 -117.69 147.55 42.81 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 173.08 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.479 ' HG2' ' CE2' ' A' ' 83' ' ' TYR . 31.5 mt-10 -62.58 125.83 25.27 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.395 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.619 ' HB3' ' HB2' ' A' ' 104' ' ' LYS . 40.0 t -47.31 132.43 9.82 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.235 175.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -55.58 -29.29 69.26 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 122.537 2.158 . . . . 0.0 112.085 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.0 t -80.16 -17.9 12.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.38 178.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.619 ' HB2' ' HB3' ' A' ' 101' ' ' CYS . 14.2 tmtt? . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.524 -179.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.707 0.289 . . . . 0.0 110.892 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -55.85 -50.54 70.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.395 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -34.3 70.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.895 0.378 . . . . 0.0 110.184 -176.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -62.47 -47.63 83.14 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.776 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.508 ' O ' ' HG2' ' A' ' 24' ' ' MET . 12.7 ptm180 -72.57 -32.34 65.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.563 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.632 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 36.4 tp -64.85 -50.28 67.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.152 -178.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -67.02 -29.92 69.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.272 0.558 . . . . 0.0 110.309 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.41 HE21 ' HA ' ' A' ' 20' ' ' ARG . 8.6 tt0 -67.69 -54.75 16.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.5 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 25.7 ptm -68.66 -34.63 76.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.068 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.632 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 12.3 tptm -56.69 -51.79 67.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.312 0.577 . . . . 0.0 110.308 178.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.48 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 41.2 tt0 -65.41 -36.33 83.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.647 -179.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.402 ' HE3' ' CE1' ' A' ' 58' ' ' TYR . 18.7 mtpp -62.94 -36.45 83.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.731 178.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 24' ' ' MET . 95.9 t -70.73 -38.55 73.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.178 0.513 . . . . 0.0 109.738 177.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 25.9 mmt -77.36 5.27 9.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.042 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 1.9 mptp? -101.53 -13.7 17.78 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.775 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.675 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 35.5 t70 -85.6 142.59 29.0 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.257 0.551 . . . . 0.0 111.927 -172.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -72.48 -44.2 62.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.463 -176.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -67.8 -38.56 83.46 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 -178.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.424 ' O ' HD23 ' A' ' 38' ' ' LEU . 46.2 t -53.71 -46.54 62.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.873 175.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.675 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 59.0 mm-40 -57.92 -52.36 65.8 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.048 0.451 . . . . 0.0 110.852 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.46 97.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.516 -176.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.1 t80 -63.71 -40.05 95.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.635 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.531 HD11 HD11 ' A' ' 50' ' ' ILE . 2.2 mm? -62.13 -49.32 76.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.371 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -66.71 -28.09 68.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.249 0.547 . . . . 0.0 110.804 -177.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.44 -33.33 54.82 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.563 -178.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -119.16 25.67 10.0 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.393 -175.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -70.0 -17.02 63.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.636 0.255 . . . . 0.0 111.616 -175.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -71.79 -39.89 69.58 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.1 t -93.41 -41.44 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.737 -172.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.493 HG12 ' SD ' ' A' ' 49' ' ' MET . 64.9 mt -92.92 141.74 14.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.029 -176.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.49 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -131.54 -179.21 5.23 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.12 -36.85 80.84 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.539 0.2 . . . . 0.0 111.539 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -62.27 -48.74 78.6 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.493 ' SD ' HG12 ' A' ' 45' ' ' ILE . 44.5 ttm -60.1 -35.97 76.38 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.774 178.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.531 HD11 HD11 ' A' ' 38' ' ' LEU . 36.6 mm -63.53 -47.8 89.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.056 178.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -70.37 -30.56 67.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.951 0.405 . . . . 0.0 110.766 -178.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.474 ' N ' ' HE3' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -75.49 -40.9 56.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.041 179.189 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.461 ' HB2' HD12 ' A' ' 94' ' ' ILE . 15.4 m -95.87 21.3 8.74 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.475 178.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.2 tp -59.13 -40.75 86.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.408 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -59.68 -41.55 90.94 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.363 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.515 ' O ' HD11 ' A' ' 96' ' ' ILE . 73.7 mmtt -64.01 -53.44 49.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.759 178.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.405 HD11 HG21 ' A' ' 94' ' ' ILE . 11.0 mp -61.06 -39.12 88.66 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.151 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.402 ' CE1' ' HE3' ' A' ' 27' ' ' LYS . 32.3 t80 -67.49 -40.95 85.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.774 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -64.49 -37.8 88.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.342 0.591 . . . . 0.0 109.9 177.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 54.9 t80 -65.33 -47.1 77.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.162 -177.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.552 ' HA ' ' HE3' ' A' ' 65' ' ' LYS . 23.7 pt -70.32 -30.51 43.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 C-N-CA 121.148 -0.221 . . . . 0.0 111.508 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -81.34 -25.19 36.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.795 -179.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 2.2 pt20 -82.51 156.0 24.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.693 -178.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 14.5 m -62.48 109.46 1.38 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.455 -177.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.552 ' HE3' ' HA ' ' A' ' 61' ' ' ILE . 93.7 mttt -83.26 -41.0 18.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.911 178.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -78.75 171.53 15.02 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.167 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -141.16 154.01 45.65 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -178.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.552 ' HB2' ' OE2' ' A' ' 81' ' ' GLU . 72.5 m -74.31 -11.45 60.27 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.507 0.504 . . . . 0.0 111.442 -170.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.21 -0.43 19.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.001 174.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 28.6 p -143.67 -28.19 0.53 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.761 176.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.496 ' O ' ' HA ' ' A' ' 68' ' ' SER . 16.5 m -114.16 151.19 33.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -100.31 7.36 44.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.585 0.231 . . . . 0.0 111.211 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.13 104.36 0.14 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.369 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -83.01 -23.92 33.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.821 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -92.73 29.68 1.72 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.492 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 31.1 p -134.4 126.62 29.93 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 174.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -83.38 120.89 26.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.302 0.572 . . . . 0.0 109.834 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -111.06 109.83 20.1 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.316 0.579 . . . . 0.0 109.879 174.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.5 tt -57.65 -61.41 2.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.108 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.2 mp -86.47 162.95 17.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.574 173.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.552 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 6.8 tp10 -141.07 145.57 36.01 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.93 6.92 87.51 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -169.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.659 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 78.5 m-85 -134.51 154.98 51.16 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.76 0.314 . . . . 0.0 110.881 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.404 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 18.8 m170 -130.48 146.07 60.18 Favored Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 174.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.462 ' CG ' ' HA ' ' A' ' 65' ' ' LYS . 69.7 Cg_endo -78.05 143.16 20.15 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.191 1.927 . . . . 0.0 111.82 174.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -144.15 150.74 38.54 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 176.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 97.5 mt -75.75 137.57 40.67 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.025 176.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.455 HG21 ' OE2' ' A' ' 97' ' ' GLU . 30.2 m -130.58 148.52 33.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 116.28 -0.418 . . . . 0.0 109.931 177.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.3 p -87.87 116.27 29.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.555 0.693 . . . . 0.0 109.551 175.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.31 95.88 5.28 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.098 -176.051 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.81 -108.31 2.33 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.849 -176.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -117.67 19.29 13.92 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.306 0.574 . . . . 0.0 109.985 177.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 11.6 p -132.48 160.49 36.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.003 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.461 HD12 ' HB2' ' A' ' 53' ' ' SER . 47.1 mt -104.67 134.65 45.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -125.49 178.14 5.8 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -175.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.515 HD11 ' O ' ' A' ' 56' ' ' LYS . 26.9 mt -130.83 113.71 25.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.882 -178.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.455 ' OE2' HG21 ' A' ' 88' ' ' VAL . 32.8 mt-10 -126.85 159.38 34.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.585 -0.279 . . . . 0.0 110.287 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.659 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 8.0 m-85 -99.31 136.08 39.78 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.981 0.42 . . . . 0.0 112.026 -175.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -115.19 158.62 22.01 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 173.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.91 139.37 43.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.749 0.309 . . . . 0.0 110.614 -175.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 33.0 t -55.07 121.82 38.42 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.117 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.61 -9.25 25.56 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.374 2.05 . . . . 0.0 112.576 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 33.4 t -82.01 -13.53 12.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.182 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.9 tptp . . . . . 0 C--N 1.324 -0.504 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.85 -178.354 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.945 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 9.9 t70 . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 120.584 0.23 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -53.26 -55.97 20.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.485 178.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.565 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 2.3 pt20 -66.17 -31.22 71.94 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.739 0.304 . . . . 0.0 110.761 -177.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.945 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 50.4 mtpt -58.27 -42.12 85.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.388 177.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.707 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 23.2 mtp180 -78.8 -41.36 30.54 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.902 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.565 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 30.1 tp -54.27 -49.75 68.85 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.737 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -75.92 -28.52 58.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.018 0.437 . . . . 0.0 110.759 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.484 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 7.7 tt0 -62.41 -55.27 29.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.913 176.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.472 ' O ' HG23 ' A' ' 28' ' ' VAL . 27.1 ptm -62.99 -35.86 81.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.755 -179.194 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.672 ' O ' ' HG2' ' A' ' 29' ' ' MET . 4.1 tppp? -55.82 -53.86 51.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 173.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.63 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 2.3 tt0 -55.07 -48.16 73.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.651 178.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.442 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 12.5 mmmt -51.84 -42.23 62.43 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.064 178.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.564 ' HA ' HD13 ' A' ' 61' ' ' ILE . 78.6 t -69.89 -37.61 73.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 121.212 0.53 . . . . 0.0 110.3 -177.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.672 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 29.1 mmm -75.23 5.82 5.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.557 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.63 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 30.5 mmtp -102.81 -18.27 15.19 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.657 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 23.1 t70 -81.27 129.28 34.54 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.731 -0.388 . . . . 0.0 111.142 -175.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -62.66 -36.58 83.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.826 -0.624 . . . . 0.0 112.2 -175.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -73.74 -36.75 65.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.834 0.35 . . . . 0.0 110.402 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 32.8 t -57.72 -50.09 78.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.406 173.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 45.8 mt-30 -61.32 -41.29 96.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.577 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.433 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -58.86 -40.84 85.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.67 177.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -67.79 -41.39 83.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.765 177.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.485 HD11 HD11 ' A' ' 50' ' ' ILE . 1.9 mm? -60.75 -45.37 94.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.366 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -72.87 -25.1 60.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.01 0.433 . . . . 0.0 110.797 -178.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -78.85 -32.13 45.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.683 -177.512 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -122.73 28.33 7.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.278 -178.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -62.84 -23.86 67.5 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.935 0.398 . . . . 0.0 111.43 -178.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -70.79 -32.95 70.22 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.289 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.9 t -94.74 -44.53 13.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.926 -172.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.6 mt -79.8 142.87 13.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.328 -174.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -127.95 176.3 7.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.423 175.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.561 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 49.1 mt-30 -58.77 -46.4 87.57 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -177.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -60.01 -40.0 87.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.756 0.312 . . . . 0.0 111.297 -178.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.486 ' HG2' HG13 ' A' ' 94' ' ' ILE . 44.1 ttm -60.06 -43.39 95.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.476 177.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.485 HD11 HD11 ' A' ' 38' ' ' LEU . 38.2 mm -62.79 -44.71 99.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.061 178.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 13.7 mm-40 -61.89 -36.42 81.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.595 -177.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.9 mtmt -75.31 -44.17 46.92 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.793 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.495 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 26.0 m -91.93 19.65 6.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.588 -174.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 45.9 tp -62.47 -37.9 87.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.853 0.358 . . . . 0.0 110.317 178.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -62.18 -39.99 94.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.352 176.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.571 ' O ' HD11 ' A' ' 96' ' ' ILE . 70.2 mmtt -61.53 -53.32 57.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.1 0.476 . . . . 0.0 110.885 178.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.16 -36.58 84.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.354 -177.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -69.58 -42.42 74.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.796 0.331 . . . . 0.0 110.157 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -56.18 -42.8 77.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.965 175.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.49 ' HA ' HE21 ' A' ' 63' ' ' GLN . 76.2 t80 -61.52 -46.97 87.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.418 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.564 HD13 ' HA ' ' A' ' 28' ' ' VAL . 36.2 pt -75.38 -31.14 23.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 -175.226 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -84.1 -19.33 34.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.762 0.315 . . . . 0.0 111.078 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.49 HE21 ' HA ' ' A' ' 60' ' ' TYR . 24.7 pt20 -88.08 -178.05 5.88 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 173.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.0 m -71.75 124.62 25.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.118 0.485 . . . . 0.0 111.345 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -78.17 -27.09 47.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.922 174.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.555 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 79.0 m-20 -99.92 -164.6 1.14 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.005 175.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.7 p -146.18 156.77 43.64 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 176.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 t -66.0 -13.34 59.69 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.212 0.529 . . . . 0.0 111.12 -173.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -78.49 -3.4 43.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.733 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.4 p -134.77 -38.92 0.8 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.235 176.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.1 p -83.39 130.55 35.05 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 177.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.423 ' H ' ' HG2' ' A' ' 72' ' ' GLU . 7.2 pt-20 -95.98 0.58 51.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.25 0.548 . . . . 0.0 110.989 -176.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -75.31 104.22 5.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.374 171.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.92 5.85 20.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.772 -175.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -70.45 -40.18 73.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.913 0.387 . . . . 0.0 110.378 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 72.5 m -86.96 113.62 22.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.593 176.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -105.42 144.58 32.0 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 173.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.678 ' HB3' ' HG ' ' A' ' 80' ' ' LEU . 44.1 m-80 -142.13 158.21 44.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.16 -175.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.43 -22.14 55.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.367 0.603 . . . . 0.0 109.399 171.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.678 ' HG ' ' HB3' ' A' ' 78' ' ' ASN . 2.6 pp -82.42 126.24 31.98 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.259 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -143.55 118.01 9.7 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.961 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.27 -8.18 68.8 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.844 -176.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.436 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 89.8 m-85 -126.28 162.19 26.04 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.555 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 16.1 m170 -125.92 148.54 63.04 Favored Pre-proline 0 CA--C 1.514 -0.416 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.419 ' O ' ' HE1' ' A' ' 60' ' ' TYR . 42.2 Cg_endo -69.81 144.27 53.24 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.226 1.951 . . . . 0.0 111.593 175.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.478 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 59.9 tttp -146.75 134.15 20.75 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.25 -178.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.408 HD22 ' H ' ' A' ' 87' ' ' LEU . 2.0 mm? -71.74 131.54 43.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 178.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.401 HG21 ' HG2' ' A' ' 97' ' ' GLU . 35.1 m -129.13 152.15 36.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.131 177.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -99.15 112.1 30.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.366 0.603 . . . . 0.0 109.55 173.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -110.19 96.82 6.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.819 -178.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.36 -99.87 0.68 Allowed Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.527 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -118.63 3.41 11.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.665 0.269 . . . . 0.0 111.405 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.4 t -124.35 150.69 45.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.784 0.326 . . . . 0.0 110.826 -176.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.495 ' HB ' ' CB ' ' A' ' 53' ' ' SER . 66.5 mt -94.33 139.13 19.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 176.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -135.57 178.39 7.08 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -175.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.571 HD11 ' O ' ' A' ' 56' ' ' LYS . 65.6 mt -121.16 101.34 10.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.616 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.401 ' HG2' HG21 ' A' ' 88' ' ' VAL . 35.4 mm-40 -95.97 -170.46 2.13 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.672 176.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.435 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 43.7 m-85 -133.65 141.89 47.81 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.281 0.562 . . . . 0.0 111.71 -175.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.478 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 46.0 p90 -122.26 151.39 41.13 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.213 172.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.436 ' HG2' ' CE1' ' A' ' 83' ' ' TYR . 41.5 mt-10 -65.77 127.76 33.27 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.193 -177.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.47 ' SG ' HG12 ' A' ' 103' ' ' VAL . 49.8 t -48.34 123.31 10.76 Favored Pre-proline 0 N--CA 1.463 0.219 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.482 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -67.83 5.57 1.02 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 123.266 2.644 . . . . 0.0 113.886 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.47 HG12 ' SG ' ' A' ' 101' ' ' CYS . 5.9 p -86.33 -19.54 8.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 O-C-N 122.1 -0.375 . . . . 0.0 110.464 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt . . . . . 0 C--N 1.334 -0.097 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.298 -176.585 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.576 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 6.3 p-10 . . . . . 0 C--O 1.226 -0.133 0 CA-C-O 120.467 0.175 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -53.61 -58.62 6.52 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.702 175.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.402 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -71.87 -30.8 65.8 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.768 -178.892 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.576 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 52.9 mtmt -64.08 -45.55 88.21 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.066 -0.254 . . . . 0.0 110.672 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -71.87 -37.54 70.17 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 178.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.4 tp -63.19 -49.92 72.36 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.946 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.403 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 75.2 mm-40 -65.95 -35.81 81.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.524 177.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -62.52 -59.11 5.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.161 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.43 ' O ' HG23 ' A' ' 28' ' ' VAL . 22.7 ptm -61.63 -40.49 95.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.938 -177.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.42 ' O ' ' HG2' ' A' ' 29' ' ' MET . 55.3 tptt -62.0 -43.19 99.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.959 0.409 . . . . 0.0 109.978 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.423 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 3.2 tp10 -60.53 -46.54 89.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.579 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -64.5 -41.81 96.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.171 -176.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 24' ' ' MET . 71.5 t -70.98 -44.51 75.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.082 -175.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.466 ' C ' ' HD3' ' A' ' 30' ' ' LYS . 90.6 mmm -71.07 -15.24 62.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.865 0.364 . . . . 0.0 110.805 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HD3' ' C ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -110.48 13.65 22.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.716 -178.761 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.567 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 26.5 t70 -85.41 131.74 34.34 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 170.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -61.31 -38.14 85.77 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.419 0.449 . . . . 0.0 111.845 -174.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -71.38 -47.22 57.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.168 0.509 . . . . 0.0 109.669 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.6 t -55.06 -55.13 17.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.496 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.596 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 5.0 pt20 -65.78 -27.73 68.5 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.433 ' HA ' ' NZ ' ' A' ' 39' ' ' LYS . . . -62.79 -45.66 91.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.309 0.576 . . . . 0.0 109.739 173.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -66.81 -40.78 88.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.711 176.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.666 HD11 HD11 ' A' ' 50' ' ' ILE . 1.6 mm? -58.99 -48.88 79.97 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.949 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' A' ' 35' ' ' GLN . 17.9 pttm -73.55 -24.0 60.06 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.015 -178.021 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.43 -41.26 76.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.118 0.485 . . . . 0.0 110.229 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -115.41 28.99 8.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.526 -174.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -69.2 -14.9 63.24 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.149 0.5 . . . . 0.0 110.62 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.54 -31.22 71.17 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.677 0.751 . . . . 0.0 109.625 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.1 t -106.05 -41.77 6.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.512 -172.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.9 mt -87.32 141.71 13.97 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.761 -171.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.403 ' O ' HG12 ' A' ' 50' ' ' ILE . 5.5 p-10 -124.26 178.07 5.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.361 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.463 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 77.3 mt-30 -58.88 -46.05 88.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.635 0.255 . . . . 0.0 111.156 -178.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 27.2 mmtm -68.54 -35.41 77.41 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -174.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 51.9 ttm -59.51 -32.06 69.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 171.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.666 HD11 HD11 ' A' ' 38' ' ' LEU . 42.3 mm -72.18 -46.59 57.56 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.594 177.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 1.7 mp0 -58.13 -46.02 86.35 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 120.97 0.414 . . . . 0.0 111.016 175.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 50.3 tptt -58.82 -40.28 83.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.821 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -104.22 17.83 23.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.981 -175.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.7 OUTLIER -60.02 -43.38 95.31 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.138 0.494 . . . . 0.0 110.114 -177.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -57.58 -40.1 78.23 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.182 176.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.599 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 6.9 mmpt? -71.46 -48.19 50.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.633 0.254 . . . . 0.0 111.272 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.503 HD21 HG21 ' A' ' 94' ' ' ILE . 95.1 mt -61.26 -39.71 91.36 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.103 0.478 . . . . 0.0 110.593 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -68.07 -40.12 82.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.243 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.73 -37.04 77.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.24 176.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -66.35 -43.68 85.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.907 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 pt -75.2 -29.92 22.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 120.713 -0.395 . . . . 0.0 112.037 -174.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -80.93 -27.05 36.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.699 0.285 . . . . 0.0 111.329 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -80.44 -176.96 5.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.928 0.394 . . . . 0.0 110.693 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.1 m -79.09 124.14 28.01 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.165 -176.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -77.67 -27.1 50.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.345 0.593 . . . . 0.0 109.99 171.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -97.97 -167.04 1.46 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.437 178.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -153.53 155.19 35.74 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.3 m -72.04 -20.08 61.74 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.301 -171.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -63.19 -21.09 65.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.167 177.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 16.3 p -115.45 -54.48 2.53 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.515 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -91.65 -179.16 5.27 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.016 -175.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.57 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 0.8 OUTLIER -93.76 24.67 3.99 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.607 -177.59 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -60.56 108.78 0.88 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.333 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -69.6 -15.28 63.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.128 0.489 . . . . 0.0 110.163 178.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -73.54 68.14 1.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.293 0.568 . . . . 0.0 109.865 174.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 40.8 m -85.13 17.32 3.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.802 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -92.1 12.84 20.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.229 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.657 ' HB2' ' HG2' ' A' ' 81' ' ' GLU . 77.0 m-20 -62.23 110.49 1.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 172.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.548 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.2 pt? -56.19 -50.99 69.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.123 -178.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.448 HD22 ' HG ' ' A' ' 79' ' ' LEU . 3.9 mm? -88.02 62.15 6.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.509 0.195 . . . . 0.0 111.0 173.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.657 ' HG2' ' HB2' ' A' ' 78' ' ' ASN . 1.6 mm-40 -72.8 159.75 33.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.959 0.409 . . . . 0.0 110.113 177.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 79.95 -8.66 49.68 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.038 -174.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.431 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 35.0 m-85 -122.17 172.57 8.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.0 m170 -129.76 144.41 52.89 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 171.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.06 135.5 19.05 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.428 2.085 . . . . 0.0 112.328 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -136.6 133.58 36.48 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 93.8 mt -71.44 138.38 49.01 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.183 -176.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.439 HG21 ' HG3' ' A' ' 97' ' ' GLU . 30.7 m -134.33 149.92 30.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.821 177.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.6 p -103.58 117.91 49.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-O 121.089 0.471 . . . . 0.0 109.983 174.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -117.97 93.92 4.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.765 -177.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 58.62 -87.96 0.02 OUTLIER Glycine 0 CA--C 1.521 0.409 0 CA-C-N 115.463 -0.79 . . . . 0.0 114.461 175.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.832 ' HD3' ' H ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -99.07 -15.19 19.11 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -170.292 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.6 p -148.6 170.73 17.46 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.224 0.535 . . . . 0.0 111.569 -173.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.503 HG21 HD21 ' A' ' 57' ' ' LEU . 59.4 mt -106.78 136.49 41.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.377 -179.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -130.06 179.2 6.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.899 0.38 . . . . 0.0 110.732 -173.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 57.9 mt -127.22 114.11 35.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.259 -178.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.439 ' HG3' HG21 ' A' ' 88' ' ' VAL . 31.6 mt-10 -114.39 153.19 30.29 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.431 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 38.2 m-85 -105.68 130.39 53.71 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.123 0.487 . . . . 0.0 111.923 -173.087 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.3 p90 -106.67 149.66 27.03 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 171.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -69.75 139.79 53.35 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.214 -0.594 . . . . 0.0 110.701 -174.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.568 ' SG ' HG12 ' A' ' 103' ' ' VAL . 49.2 t -48.07 123.69 10.38 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.241 177.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.96 -14.02 40.82 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.306 2.671 . . . . 0.0 113.887 -172.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.568 HG12 ' SG ' ' A' ' 101' ' ' CYS . 8.4 p -67.81 -25.17 31.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.977 0.418 . . . . 0.0 110.408 178.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.679 -179.819 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 . . . . . 0 N--CA 1.461 0.095 0 CA-C-O 121.024 0.44 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.535 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 81.3 t80 -63.52 -51.79 63.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.839 175.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.418 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -71.17 -31.84 68.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -177.514 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -64.14 -48.86 74.38 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.702 177.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 17' ' ' PHE . 6.1 ptp180 -64.89 -31.41 72.63 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.8 tp -68.67 -49.37 59.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.254 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.5 -35.81 81.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.937 0.399 . . . . 0.0 110.03 176.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.423 HE21 ' HA ' ' A' ' 20' ' ' ARG . 9.3 tt0 -60.98 -55.48 32.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.265 179.464 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.411 ' O ' HG23 ' A' ' 28' ' ' VAL . 24.8 ptm -65.27 -38.34 89.99 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.153 -179.182 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.5 tptm -63.56 -41.71 98.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.155 0.503 . . . . 0.0 110.013 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.476 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 15.2 tm-20 -58.34 -47.11 84.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.954 177.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -58.63 -55.23 37.77 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.706 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 24' ' ' MET . 96.3 t -62.65 -42.21 95.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.949 0.404 . . . . 0.0 111.167 -174.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.5 mmt -77.51 -5.62 50.67 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -174.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HE3' ' O ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -127.24 6.51 6.43 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.306 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.588 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 0.8 OUTLIER -84.23 136.91 33.76 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.343 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -60.09 -49.18 78.67 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.325 -169.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -65.24 -35.79 82.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.153 0.502 . . . . 0.0 110.669 -174.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 99.5 t -62.21 -37.82 79.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.095 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.588 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 70.8 mm-40 -58.73 -44.69 90.54 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.321 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.99 -48.17 82.53 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.107 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -62.23 -41.83 98.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.514 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 38' ' ' LEU . 2.7 mm? -59.8 -42.21 92.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.802 -178.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -82.42 -21.79 35.58 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.881 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -62.3 -50.89 69.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.556 0.693 . . . . 0.0 110.067 175.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -112.83 36.03 3.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.586 -177.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 43' ' ' GLU . 7.3 pt-20 -52.15 -40.54 61.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.464 -175.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.442 ' N ' ' HG3' ' A' ' 42' ' ' GLU . 15.2 tp10 -85.49 -13.17 49.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.078 0.466 . . . . 0.0 111.058 -173.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.3 t -99.07 -38.25 6.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.112 0.482 . . . . 0.0 110.754 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.8 mt -83.13 150.18 4.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.648 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -124.23 165.52 17.48 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 173.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -60.43 -40.06 89.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.073 0.463 . . . . 0.0 111.502 -175.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.466 ' HD3' ' HA ' ' A' ' 48' ' ' LYS . 68.1 mmtt -73.03 -31.85 64.71 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.579 -178.199 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 54.4 ttm -54.41 -43.77 71.78 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.897 0.379 . . . . 0.0 110.193 171.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.11 -44.19 94.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.751 178.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.528 ' HA ' ' HB2' ' A' ' 54' ' ' LEU . 41.2 mt-10 -70.97 -38.45 72.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.759 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -66.57 -23.98 66.28 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.034 0.445 . . . . 0.0 111.372 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.4 m -120.54 25.68 9.62 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.25 176.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.528 ' HB2' ' HA ' ' A' ' 51' ' ' GLU . 51.4 tp -61.58 -34.28 75.32 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.423 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -67.34 -33.49 75.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.031 176.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.439 ' O ' HD11 ' A' ' 96' ' ' ILE . 54.4 mmtt -74.6 -43.77 53.95 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.511 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.84 -37.9 80.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.954 0.407 . . . . 0.0 109.989 175.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -74.98 -39.21 61.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.337 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.452 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 40.8 tt0 -63.25 -32.06 73.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.304 0.573 . . . . 0.0 109.858 176.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.487 ' HE1' ' C ' ' A' ' 85' ' ' PRO . 69.0 t80 -63.76 -54.88 28.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.408 178.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 21.5 pt -65.51 -28.91 45.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.936 -174.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.452 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 9.4 pt-20 -78.23 -37.03 46.25 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.044 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -86.33 113.49 22.36 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.693 0.282 . . . . 0.0 111.67 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.483 ' HB2' ' HD3' ' A' ' 85' ' ' PRO . 11.5 m 53.55 62.13 2.79 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.597 173.22 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -63.49 -27.13 69.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 122.177 0.989 . . . . 0.0 108.777 173.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.3 p30 -138.52 -157.28 0.76 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.272 -1.331 . . . . 0.0 108.188 173.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.6 p -151.25 153.41 34.82 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 170.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 t -65.1 -29.87 70.77 Favored 'General case' 0 C--N 1.313 -1.014 0 O-C-N 123.782 0.677 . . . . 0.0 110.373 -170.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -55.79 -36.12 67.05 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.978 178.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.2 p -103.72 -6.71 21.26 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.57 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -105.27 168.44 9.07 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -95.05 -13.01 25.56 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -76.0 114.73 14.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.343 178.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -87.41 -22.55 24.94 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 175.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -75.84 75.76 2.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.897 178.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 38.4 t -163.55 133.91 4.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.766 178.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -116.29 77.78 1.13 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.029 0.442 . . . . 0.0 111.036 -175.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -72.25 136.58 46.37 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.358 172.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 46.9 tp -62.84 -67.45 0.42 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.476 ' HB3' ' CD2' ' A' ' 83' ' ' TYR . 6.0 mp -88.08 90.71 8.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.742 170.051 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -83.0 144.84 29.68 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.86 -7.8 78.82 Favored Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -169.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.476 ' CD2' ' HB3' ' A' ' 80' ' ' LEU . 46.1 m-85 -126.07 164.05 21.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.578 -0.311 . . . . 0.0 110.334 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -128.51 154.23 79.4 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 169.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.564 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 71.8 Cg_endo -80.14 165.79 21.2 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.467 2.111 . . . . 0.0 112.167 177.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -152.69 147.22 25.85 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 173.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 60' ' ' TYR . 2.5 mm? -78.52 140.6 38.54 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.447 177.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.9 m -137.81 141.05 39.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.579 173.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.5 p -89.17 129.69 39.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.171 0.51 . . . . 0.0 111.168 -178.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -132.3 96.08 3.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.736 175.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.52 -113.8 4.6 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.753 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.471 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 29.4 mmt180 -111.61 14.09 21.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.113 0.483 . . . . 0.0 110.321 177.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 48.3 t -123.98 148.05 47.27 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.276 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 89.4 mt -110.63 125.94 67.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.032 178.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -109.68 174.78 5.71 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.881 -175.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.439 HD11 ' O ' ' A' ' 56' ' ' LYS . 58.0 mt -126.38 105.74 14.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.625 -176.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.564 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 17.4 mm-40 -95.93 -173.88 2.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.877 178.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -135.61 143.77 45.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.037 0.446 . . . . 0.0 111.098 179.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -129.71 155.95 45.07 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 173.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -71.79 137.47 47.66 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.831 0.348 . . . . 0.0 110.598 -178.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.561 ' SG ' HG12 ' A' ' 103' ' ' VAL . 43.9 t -55.82 122.83 48.96 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.108 178.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -71.02 -7.77 22.15 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.956 2.437 . . . . 0.0 113.536 -175.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.561 HG12 ' SG ' ' A' ' 101' ' ' CYS . 3.8 p -69.67 -19.67 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.009 0.433 . . . . 0.0 110.429 178.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.003 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.621 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 0.5 OUTLIER . . . . . 0 CA--C 1.518 -0.282 0 CA-C-O 120.444 0.164 . . . . 0.0 110.951 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -59.14 -50.0 75.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.83 0.348 . . . . 0.0 110.063 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -29.25 65.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.161 -179.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -63.24 -49.07 75.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.405 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.621 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 20.5 mtm105 -69.03 -40.76 78.44 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 121.456 0.646 . . . . 0.0 109.449 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 34.1 tp -54.54 -49.29 70.64 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.491 -1.231 . . . . 0.0 111.212 177.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -75.45 -28.32 59.25 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.638 177.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.414 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 8.6 tp-100 -62.0 -52.64 63.18 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.611 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.2 ptm -66.3 -36.43 82.94 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.407 177.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -55.3 -50.0 70.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.942 0.401 . . . . 0.0 110.487 175.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -58.04 -47.04 84.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.503 178.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.42 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 25.9 mtpp -59.8 -42.67 93.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.811 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.612 HG12 HG11 ' A' ' 34' ' ' VAL . 84.5 t -67.81 -36.48 75.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.076 -176.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.4 ptp -82.65 -0.92 49.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.179 0.514 . . . . 0.0 110.387 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.5 tptt -91.61 -12.17 35.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.294 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 24.9 t70 -85.48 136.97 33.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.193 -176.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.96 -47.03 75.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.652 -177.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -63.52 -45.37 90.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.036 0.446 . . . . 0.0 110.444 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.612 HG11 HG12 ' A' ' 28' ' ' VAL . 49.7 t -56.41 -56.4 13.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.824 -179.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.521 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.2 pt20 -66.13 -29.95 70.35 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -176.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.62 -40.75 97.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.016 0.436 . . . . 0.0 109.932 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.468 ' CE2' HD11 ' A' ' 45' ' ' ILE . 93.1 t80 -70.23 -36.34 74.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.95 177.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.4 mm? -56.84 -49.46 75.37 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.412 178.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.521 ' HG2' ' O ' ' A' ' 35' ' ' GLN . 5.2 ptpp? -77.7 -21.33 52.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.237 0.542 . . . . 0.0 110.624 -178.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.81 -60.72 2.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.327 174.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -102.48 33.85 3.0 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.737 -174.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -61.62 -20.64 63.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.417 178.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -85.89 -16.06 39.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.807 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 41.3 t -109.94 -42.46 5.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.854 0.359 . . . . 0.0 111.591 -173.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.468 HD11 ' CE2' ' A' ' 37' ' ' PHE . 56.3 mt -78.43 144.0 11.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.668 -175.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -106.73 165.39 11.34 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.739 175.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -58.04 -45.15 87.45 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.925 0.393 . . . . 0.0 111.023 176.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.595 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 14.1 mmmm -67.01 -37.35 84.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.708 0.766 . . . . 0.0 110.323 -178.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.435 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 19.1 ttt -57.2 -37.61 72.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.296 176.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 28.3 mm -63.73 -54.61 29.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.404 178.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.595 ' OE2' ' HE2' ' A' ' 48' ' ' LYS . 2.0 pp20? -63.1 -43.88 97.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.086 0.469 . . . . 0.0 111.414 -178.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.56 ' HE2' ' HA ' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -57.3 -31.91 66.12 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.839 178.124 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 73.3 p -108.92 14.26 24.26 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.457 -178.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.8 tp -59.05 -34.45 71.95 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.928 0.394 . . . . 0.0 110.645 -179.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -66.91 -38.25 85.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.754 176.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.485 ' O ' HD11 ' A' ' 96' ' ' ILE . 27.8 mmmt -66.04 -47.97 72.6 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.058 0.456 . . . . 0.0 109.944 176.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.792 ' HG ' HD21 ' A' ' 87' ' ' LEU . 11.0 mp -64.64 -35.88 82.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.308 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -69.34 -43.05 74.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.73 0.3 . . . . 0.0 110.247 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.502 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 9.2 tp10 -58.66 -37.19 75.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.815 0.817 . . . . 0.0 109.801 174.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.493 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 87.9 t80 -61.83 -47.85 83.2 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.581 -1.19 . . . . 0.0 111.689 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.548 HD13 ' HA ' ' A' ' 28' ' ' VAL . 29.8 pt -76.36 -30.54 19.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -177.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.502 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 10.1 pt-20 -79.85 -20.09 46.82 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.466 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 10.1 pt20 -82.29 175.8 9.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.862 0.363 . . . . 0.0 110.206 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.1 m -68.35 102.88 1.49 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.102 0.477 . . . . 0.0 110.963 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -69.62 -31.15 69.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.282 177.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -93.76 -165.77 1.38 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.049 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -157.58 162.66 38.77 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.042 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.516 ' HA ' ' O ' ' A' ' 71' ' ' SER . 8.0 p -69.32 -18.93 63.87 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 123.48 0.487 . . . . 0.0 111.908 -174.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -77.83 4.98 10.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.109 0.48 . . . . 0.0 110.946 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 26.1 p -145.51 -44.51 0.21 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.712 175.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' A' ' 68' ' ' SER . 2.5 m -105.32 125.37 50.91 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -87.44 11.02 15.66 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.011 0.434 . . . . 0.0 111.232 -177.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.65 115.16 3.42 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.924 177.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -86.52 -5.3 59.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.679 176.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -60.95 -47.58 85.8 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.9 -177.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 19.0 p -101.28 143.73 30.99 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.8 -176.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -94.95 104.55 16.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.06 0.457 . . . . 0.0 110.238 176.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.33 103.34 11.03 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 174.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.6 tp -52.53 -61.95 1.95 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.727 -177.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.612 ' HB3' ' HB2' ' A' ' 83' ' ' TYR . 4.5 mm? -84.89 87.38 7.34 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.28 128.52 36.52 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.561 0.696 . . . . 0.0 110.785 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.25 -9.66 65.2 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.354 -175.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.612 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . 37.0 m-85 -117.39 168.39 10.4 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 122.473 0.309 . . . . 0.0 110.517 178.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.423 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 12.2 m170 -131.83 148.22 69.05 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.543 172.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -76.63 136.73 17.49 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.211 1.94 . . . . 0.0 111.577 176.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.473 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 40.3 ttpt -136.86 135.72 38.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.08 0.467 . . . . 0.0 110.191 177.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.792 HD21 ' HG ' ' A' ' 57' ' ' LEU . 1.0 OUTLIER -67.65 130.42 42.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.369 177.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.5 m -130.51 148.62 33.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 120.939 0.4 . . . . 0.0 110.88 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.7 p -97.64 115.08 36.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 173.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -117.89 96.17 5.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.447 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 63.56 -100.61 0.38 Allowed Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.481 -0.782 . . . . 0.0 112.827 177.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -112.18 15.16 20.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.144 0.497 . . . . 0.0 111.758 -176.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.1 p -143.85 149.02 36.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.681 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 62.6 mt -98.78 132.66 43.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 174.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -132.9 178.3 6.98 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.051 0.453 . . . . 0.0 110.699 -171.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.485 HD11 ' O ' ' A' ' 56' ' ' LYS . 40.7 mt -119.62 113.96 42.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.329 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -105.23 178.52 4.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.163 176.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.528 ' CE1' ' HB2' ' A' ' 80' ' ' LEU . 16.3 m-85 -127.59 129.16 46.8 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.636 179.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.473 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 54.0 p90 -113.17 150.78 31.76 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 174.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -65.21 129.96 41.61 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.403 -178.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 36.1 t -45.19 122.5 5.11 Favored Pre-proline 0 N--CA 1.463 0.21 0 O-C-N 123.409 0.443 . . . . 0.0 109.81 173.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.47 -30.09 86.95 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.856 2.371 . . . . 0.0 111.867 -177.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 16.9 t -66.63 -25.35 34.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.355 -178.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt . . . . . 0 N--CA 1.462 0.16 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.465 -174.265 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.74 0.305 . . . . 0.0 110.526 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -64.46 -48.26 75.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.67 178.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.71 -32.8 70.14 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 -178.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HE3' ' HB3' ' A' ' 19' ' ' LYS . 9.1 mmmt -57.74 -55.69 31.65 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.771 177.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.435 ' HA ' ' HB2' ' A' ' 23' ' ' GLN . 7.4 ptm85 -69.36 -25.73 64.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.381 -176.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.7 tp -68.74 -50.7 48.5 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.964 0.411 . . . . 0.0 111.0 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -73.05 -30.75 63.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.462 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.435 ' HB2' ' HA ' ' A' ' 20' ' ' ARG . 8.2 mt-30 -60.24 -57.0 14.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.768 178.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.443 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.6 ptm -57.51 -43.11 83.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.095 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.8 tptp -63.07 -39.58 95.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.748 0.309 . . . . 0.0 110.808 177.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -61.61 -50.72 71.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.582 178.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -56.27 -48.57 76.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.012 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 24' ' ' MET . 89.1 t -60.43 -43.0 93.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.101 0.477 . . . . 0.0 110.569 -179.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.6 mtp -86.26 13.92 7.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.143 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -110.66 -34.04 6.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.98 0.419 . . . . 0.0 110.555 177.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.69 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 25.2 t70 -59.58 127.22 30.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.282 -174.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -69.59 -25.4 63.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.44 -174.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -83.04 -35.96 25.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.409 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.2 t -57.43 -47.13 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.875 0.369 . . . . 0.0 110.46 171.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.69 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 47.8 mt-30 -65.24 -36.65 84.81 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.319 0.581 . . . . 0.0 110.434 179.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.55 -39.99 93.09 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.333 175.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.55 ' CD2' HD23 ' A' ' 87' ' ' LEU . 58.0 t80 -66.07 -40.66 91.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.792 176.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 38' ' ' LEU . 2.1 mm? -59.79 -42.01 92.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.291 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -80.63 -24.11 39.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.118 0.485 . . . . 0.0 110.655 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.04 -53.24 52.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.556 0.693 . . . . 0.0 110.124 178.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -113.94 31.93 6.21 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.462 -173.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 9.8 pt-20 -62.91 -18.86 63.61 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.573 -178.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -77.71 -27.92 50.78 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.491 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 37.9 t -103.75 -37.18 4.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.55 -173.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.43 HD11 ' CZ ' ' A' ' 37' ' ' PHE . 74.0 mt -80.03 148.43 5.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.681 -174.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -130.06 174.5 9.73 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 174.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -59.24 -44.55 92.35 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 -175.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -67.17 -36.52 81.95 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.965 0.412 . . . . 0.0 111.149 -175.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 46.7 ttm -58.18 -38.0 75.83 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.842 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.2 mm -68.18 -48.48 73.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.622 176.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -53.47 -48.77 68.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.161 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.619 ' N ' ' HE2' ' A' ' 52' ' ' LYS . 0.8 OUTLIER -65.76 -43.25 89.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 -178.353 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.426 ' O ' HD13 ' A' ' 57' ' ' LEU . 8.3 m -89.95 13.02 15.75 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.189 -173.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.92 -33.9 69.27 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.028 0.442 . . . . 0.0 110.668 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -70.29 -37.44 74.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.585 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.456 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.6 mmmt -69.16 -42.62 75.66 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 120.911 0.386 . . . . 0.0 110.398 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.885 ' HG ' HD21 ' A' ' 87' ' ' LEU . 9.6 mp -61.78 -40.72 96.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.996 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -69.21 -44.37 72.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.104 0.478 . . . . 0.0 110.238 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -54.23 -45.85 72.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.778 174.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.457 ' CG ' HD13 ' A' ' 87' ' ' LEU . 32.9 t80 -60.25 -50.81 72.19 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.846 -1.07 . . . . 0.0 112.768 -178.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.469 ' O ' ' HE2' ' A' ' 65' ' ' LYS . 29.8 pt -64.82 -30.28 49.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -173.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.425 ' HG2' HG13 ' A' ' 61' ' ' ILE . 6.7 mm-40 -90.01 -29.69 18.26 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.429 HE21 ' HA ' ' A' ' 60' ' ' TYR . 22.5 pt20 -85.87 133.13 33.98 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.686 -176.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.481 ' HB3' ' HG3' ' A' ' 85' ' ' PRO . 15.2 t 49.7 40.12 19.22 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.287 0.565 . . . . 0.0 112.254 168.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HE2' ' O ' ' A' ' 61' ' ' ILE . 11.8 ptpt -63.85 -24.32 67.7 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.302 0.572 . . . . 0.0 110.203 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.518 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 34.1 p30 -130.82 -170.35 2.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.026 171.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.0 p -152.58 164.1 38.31 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 176.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.523 ' HB3' ' OE2' ' A' ' 81' ' ' GLU . 31.0 t -63.48 -37.01 85.65 Favored 'General case' 0 C--N 1.317 -0.805 0 O-C-N 123.294 0.371 . . . . 0.0 110.973 -170.089 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.653 ' CZ ' ' HG3' ' A' ' 104' ' ' LYS . 2.6 t80 -55.56 -21.99 19.77 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.246 0.618 . . . . 0.0 111.935 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.5 p -124.28 11.57 8.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.159 0.504 . . . . 0.0 110.204 -179.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.4 ' HB3' ' HA ' ' A' ' 68' ' ' SER . 31.5 t -104.68 121.25 43.19 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.806 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -84.05 -21.9 31.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.805 178.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.03 137.82 32.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.291 174.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -83.72 -21.23 32.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.116 -176.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -100.27 27.95 5.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.052 0.453 . . . . 0.0 111.082 -172.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 31.7 t -80.65 149.94 29.62 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -102.1 112.04 24.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.862 0.363 . . . . 0.0 111.688 -176.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -176.27 149.15 0.82 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.609 173.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.5 mp -100.32 -41.72 6.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.184 0.516 . . . . 0.0 110.49 -177.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.438 ' HG ' ' CE2' ' A' ' 98' ' ' TYR . 3.1 mm? -72.45 112.01 8.14 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.381 -177.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.523 ' OE2' ' HB3' ' A' ' 68' ' ' SER . 4.9 tp10 -95.33 138.74 32.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.148 176.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 78.05 -7.66 42.68 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.367 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -125.6 153.75 43.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 117.237 0.519 . . . . 0.0 111.2 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.518 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 13.1 m170 -129.5 157.51 76.18 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 168.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.481 ' HG3' ' HB3' ' A' ' 64' ' ' SER . 73.0 Cg_endo -80.21 148.53 19.07 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.526 2.151 . . . . 0.0 111.213 176.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.632 ' HB2' ' CD1' ' A' ' 99' ' ' TYR . 20.7 ttpp -137.8 144.11 41.38 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.081 0.467 . . . . 0.0 109.874 175.332 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.885 HD21 ' HG ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -68.69 128.68 37.53 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.744 176.137 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 15.6 m -128.02 145.57 34.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.067 179.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 10.8 p -103.69 115.86 46.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.646 0.736 . . . . 0.0 109.881 174.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -114.71 95.51 5.27 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.274 179.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.53 -115.08 6.08 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.876 -176.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -107.05 18.61 21.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.069 0.461 . . . . 0.0 111.02 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.0 m -131.05 143.2 50.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.821 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 77.1 mt -102.18 124.15 55.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -121.62 178.33 4.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -175.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.456 HD11 ' O ' ' A' ' 56' ' ' LYS . 54.2 mt -125.02 112.57 32.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.707 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -126.93 158.21 37.42 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.438 ' CE2' ' HG ' ' A' ' 80' ' ' LEU . 12.9 m-85 -97.24 158.28 15.53 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -166.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.632 ' CD1' ' HB2' ' A' ' 86' ' ' LYS . 55.3 p90 -139.6 160.92 38.76 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.356 175.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -72.32 129.42 38.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.082 0.468 . . . . 0.0 111.586 -179.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 44.0 t -46.88 122.02 7.13 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.607 172.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.89 -22.26 49.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.648 2.232 . . . . 0.0 112.258 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.8 t -68.06 -15.96 20.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.951 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.653 ' HG3' ' CZ ' ' A' ' 69' ' ' TYR . 28.3 tttm . . . . . 0 N--CA 1.456 -0.161 0 CA-C-O 121.167 0.508 . . . . 0.0 110.263 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.602 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 1.5 m-20 . . . . . 0 CA--C 1.52 -0.175 0 CA-C-O 120.649 0.261 . . . . 0.0 110.669 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -49.5 -57.1 7.67 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.467 -178.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.425 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 1.5 pt20 -67.59 -29.65 69.05 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.463 -175.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.725 ' HE2' ' HA ' ' A' ' 19' ' ' LYS . 9.5 mmpt? -68.04 -37.72 81.67 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.864 -0.335 . . . . 0.0 111.296 -178.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.602 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 54.3 mtt180 -70.34 -40.7 73.96 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.646 0.736 . . . . 0.0 109.051 174.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.6 tp -57.11 -49.31 76.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.232 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 11.0 mm-40 -66.14 -30.56 71.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.15 0.5 . . . . 0.0 110.536 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.487 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 22.5 tt0 -70.12 -53.21 18.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.794 -176.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.485 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.8 ptm -67.82 -36.33 80.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.633 178.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -58.13 -42.39 85.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.16 0.505 . . . . 0.0 109.841 175.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.448 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 3.7 tp10 -62.58 -49.31 75.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.961 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -54.51 -48.78 71.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.352 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 24' ' ' MET . 92.3 t -61.12 -45.18 99.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.128 -178.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.7 ptp -82.64 3.4 29.05 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.417 -176.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 13.9 mptt -106.13 -6.13 18.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.688 0.28 . . . . 0.0 110.957 177.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.691 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 15.2 t70 -85.63 129.48 34.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.676 0.274 . . . . 0.0 110.504 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -65.12 -36.74 85.22 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.466 -174.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.43 -38.95 68.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.979 -176.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.4 t -55.75 -49.97 70.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.518 174.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 57.0 mt-30 -61.67 -41.02 96.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.899 -178.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.741 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . . . -57.39 -42.1 81.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.72 176.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.501 ' CG ' ' HB3' ' A' ' 87' ' ' LEU . 54.6 t80 -69.62 -39.91 76.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.321 177.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.44 HD11 HD11 ' A' ' 50' ' ' ILE . 1.7 mm? -57.3 -43.28 83.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.41 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.741 ' HE2' ' HA ' ' A' ' 36' ' ' ALA . 52.6 pttt -83.94 -17.76 39.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 111.121 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.83 -52.99 37.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.102 174.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -111.33 33.05 4.9 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.721 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.66 -33.14 63.82 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -175.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -82.09 -23.63 35.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.034 0.445 . . . . 0.0 111.128 -177.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.7 t -91.81 -41.88 13.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.193 0.521 . . . . 0.0 110.593 -175.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 37' ' ' PHE . 74.1 mt -73.13 146.67 10.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.549 -178.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -120.72 161.29 21.68 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -60.61 -37.85 82.75 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.919 176.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.571 ' O ' ' HG2' ' A' ' 52' ' ' LYS . 13.3 mmmm -63.64 -37.54 87.71 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.172 175.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.547 ' HG2' HG13 ' A' ' 94' ' ' ILE . 46.6 ttm -64.0 -32.38 73.91 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.454 177.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.44 HD11 HD11 ' A' ' 38' ' ' LEU . 35.5 mm -62.3 -54.44 34.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.331 -179.511 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 2.0 pt-20 -60.81 -47.1 87.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.842 0.353 . . . . 0.0 111.757 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 48' ' ' LYS . 74.4 mmtt -55.87 -48.08 76.2 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.383 0.611 . . . . 0.0 110.536 178.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.533 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.4 m -94.37 13.61 23.13 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.565 -173.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -54.44 -47.85 72.4 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.537 0.684 . . . . 0.0 110.265 178.81 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -56.22 -40.84 74.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.735 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.527 ' O ' HD11 ' A' ' 96' ' ' ILE . 13.6 mmmm -70.18 -44.04 69.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.994 -179.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 53' ' ' SER . 75.1 mt -62.74 -38.88 92.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.24 0.543 . . . . 0.0 110.187 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -69.74 -41.43 75.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.249 177.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.06 -37.78 80.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.012 0.434 . . . . 0.0 110.511 176.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.47 ' CD1' HD13 ' A' ' 87' ' ' LEU . 89.1 t80 -56.38 -50.51 71.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.105 177.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.2 pt -75.49 -29.71 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.812 -178.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -66.42 -46.75 75.46 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.517 177.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -65.81 -175.16 0.27 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.85 -0.613 . . . . 0.0 112.11 -177.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.796 ' HB3' ' HA ' ' A' ' 78' ' ' ASN . 2.9 p -59.92 102.6 0.16 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.193 179.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -68.88 -33.1 73.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.469 0.652 . . . . 0.0 110.349 -178.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -124.94 -156.2 0.71 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 173.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.682 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -148.53 152.1 36.26 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 119.659 -0.816 . . . . 0.0 109.843 174.536 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.654 ' HA ' ' O ' ' A' ' 71' ' ' SER . 0.7 OUTLIER -74.68 -23.34 58.61 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.405 -169.951 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.404 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 13.8 t80 -58.26 -20.65 43.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.153 176.17 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.3 p -118.27 -47.05 2.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.967 0.413 . . . . 0.0 110.862 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.654 ' O ' ' HA ' ' A' ' 68' ' ' SER . 8.6 m -100.85 118.37 36.77 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.722 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -83.44 56.57 3.63 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.755 0.788 . . . . 0.0 110.18 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -85.43 122.58 29.78 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.939 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -75.74 -15.43 60.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.037 -173.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -119.15 -2.73 10.68 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -174.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 44.7 t -73.18 114.11 11.0 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.893 0.378 . . . . 0.0 110.433 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -77.31 115.59 17.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.886 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.796 ' HA ' ' HB3' ' A' ' 64' ' ' SER . 10.6 m-80 -111.34 132.46 54.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.401 -176.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.405 HD22 ' N ' ' A' ' 79' ' ' LEU . 3.1 mm? -89.6 -79.25 0.34 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.811 -0.632 . . . . 0.0 109.331 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB3' ' HD2' ' A' ' 83' ' ' TYR . 7.2 mp -87.35 88.39 7.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.062 175.138 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -64.27 144.4 57.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.66 -179.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.21 -8.1 72.46 Favored Glycine 0 N--CA 1.445 -0.752 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.201 -177.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.452 ' HD2' ' HB3' ' A' ' 80' ' ' LEU . 61.2 m-85 -121.58 167.34 13.0 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 178.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -131.85 145.69 58.58 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 172.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -79.67 135.29 11.46 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.414 2.076 . . . . 0.0 111.709 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.66 139.68 53.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.309 0.576 . . . . 0.0 109.784 173.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.516 HD21 HD22 ' A' ' 57' ' ' LEU . 1.1 tp -77.39 131.52 38.08 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.054 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.453 ' CG2' ' HB3' ' A' ' 95' ' ' ASP . 30.0 m -136.31 170.0 19.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.3 p -112.92 114.52 47.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.368 0.604 . . . . 0.0 110.27 175.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -121.14 107.96 13.22 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.644 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.26 -112.47 3.65 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.396 -178.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . 0.433 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 30.7 mmt180 -117.92 12.01 13.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.167 0.508 . . . . 0.0 109.932 177.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 38.1 p -128.36 150.79 49.94 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.078 -177.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.547 HG13 ' HG2' ' A' ' 49' ' ' MET . 77.9 mt -86.38 131.91 33.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 176.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.453 ' HB3' ' CG2' ' A' ' 88' ' ' VAL . 13.6 t0 -119.5 169.26 10.2 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.932 -170.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.527 HD11 ' O ' ' A' ' 56' ' ' LYS . 60.5 mt -126.86 113.93 35.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.908 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -118.14 159.93 22.43 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 175.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -108.84 129.0 55.39 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.176 0.513 . . . . 0.0 111.527 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 45.8 p90 -108.69 153.84 22.87 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -73.41 135.54 44.21 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.541 -176.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.575 ' SG ' HG12 ' A' ' 103' ' ' VAL . 47.7 t -45.3 126.3 5.86 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.802 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.51 -13.65 22.05 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.364 2.709 . . . . 0.0 113.885 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.575 HG12 ' SG ' ' A' ' 101' ' ' CYS . 9.9 p -66.9 -23.08 30.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 121.041 0.448 . . . . 0.0 110.348 178.213 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 9.0 mmmm . . . . . 0 C--N 1.332 -0.178 0 CA-C-O 121.578 0.704 . . . . 0.0 109.85 174.503 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.697 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 0.5 OUTLIER . . . . . 0 C--O 1.227 -0.083 0 CA-C-O 120.428 0.156 . . . . 0.0 110.635 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -55.96 -50.95 69.38 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.332 175.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.04 -30.67 69.08 Favored 'General case' 0 C--O 1.226 -0.179 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -178.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 29.5 mmmt -60.33 -47.74 84.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.354 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.697 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 14.0 mtm-85 -71.06 -53.31 15.15 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.1 -51.11 70.61 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.506 -174.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -75.98 -28.28 57.78 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 -176.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 8.9 tt0 -64.45 -55.84 18.2 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.079 176.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.604 ' O ' HG23 ' A' ' 28' ' ' VAL . 27.6 ptm -62.0 -40.78 96.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.72 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HA ' HD21 ' A' ' 54' ' ' LEU . 80.8 tttt -62.8 -42.58 99.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.43 -178.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.494 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 14.3 tt0 -62.68 -45.97 90.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.864 0.364 . . . . 0.0 110.106 177.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.0 mtpt -55.46 -45.21 76.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.456 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 24' ' ' MET . 72.1 t -61.77 -42.42 94.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.678 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.8 ptp -84.77 14.61 4.57 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.29 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.494 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 2.4 mptm? -115.25 -14.83 11.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.059 176.092 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.639 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 19.6 t70 -74.16 135.33 42.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.069 0.461 . . . . 0.0 110.662 -177.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -66.72 -36.67 83.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.965 -175.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -75.3 -35.86 61.22 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.017 0.437 . . . . 0.0 110.065 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.1 t -59.66 -41.01 83.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.487 174.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.639 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 74.1 mm-40 -57.15 -49.03 77.2 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.139 0.495 . . . . 0.0 110.04 176.225 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -56.14 -40.54 73.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.476 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.32 -43.54 85.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.809 0.337 . . . . 0.0 110.981 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.526 HD11 HD11 ' A' ' 50' ' ' ILE . 3.5 mm? -63.02 -43.25 99.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.824 -177.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -70.77 -32.62 69.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.188 0.518 . . . . 0.0 110.721 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -74.36 -29.57 61.62 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.333 -177.727 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -118.27 28.54 8.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.184 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -63.34 -16.95 61.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.608 0.718 . . . . 0.0 109.931 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -73.89 -25.84 60.23 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.908 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.9 t -119.96 -33.73 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -170.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.515 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 73.1 mt -71.8 143.83 13.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.358 0.599 . . . . 0.0 112.203 -172.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -120.1 166.65 13.12 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.91 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -62.52 -41.64 98.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.333 0.587 . . . . 0.0 109.588 174.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -63.89 -37.64 88.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.618 -179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.515 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 54.0 ttm -58.56 -39.44 80.27 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.551 176.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.526 HD11 HD11 ' A' ' 38' ' ' LEU . 46.6 mm -67.29 -48.31 78.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.742 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -61.78 -37.77 85.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.288 -178.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.473 ' C ' ' HD3' ' A' ' 52' ' ' LYS . 1.1 tmtp? -71.7 -45.99 60.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.386 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.8 m -92.46 16.55 11.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.452 -173.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -56.52 -40.07 74.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.255 0.55 . . . . 0.0 110.383 178.934 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -62.1 -45.67 92.44 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.462 177.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.467 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.6 mmmt -64.88 -49.57 69.99 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.891 0.377 . . . . 0.0 110.752 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.413 ' CD2' ' HG ' ' A' ' 87' ' ' LEU . 90.0 mt -60.76 -39.12 87.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.886 -178.239 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -69.9 -43.08 72.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.696 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -61.2 -31.74 71.5 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.336 0.589 . . . . 0.0 109.839 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.477 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 34.4 t80 -66.4 -46.23 77.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.189 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' A' ' 28' ' ' VAL . 31.2 pt -75.5 -29.01 20.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -176.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -74.23 -35.62 63.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.533 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 10.1 pt20 -75.4 -175.76 2.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.027 0.441 . . . . 0.0 111.016 -178.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.0 t -71.35 93.71 1.16 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.299 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -73.83 -26.98 60.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.29 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -96.09 -172.75 2.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.441 177.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.579 ' HA ' ' ND2' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -141.56 154.21 45.31 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.602 179.573 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 71' ' ' SER . 17.5 m -72.4 -11.06 60.53 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.847 -173.23 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -79.5 -3.56 47.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.093 0.473 . . . . 0.0 110.584 176.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 26.0 p -132.42 -27.55 1.75 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.153 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.513 ' O ' ' HA ' ' A' ' 68' ' ' SER . 19.2 m -114.52 115.8 27.8 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 175.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -76.21 -29.25 57.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -173.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -62.86 131.43 48.76 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.586 0.708 . . . . 0.0 110.98 -169.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -62.99 -22.45 66.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.739 -172.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 -64.77 -22.19 66.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.959 0.409 . . . . 0.0 110.967 -177.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 53.1 m -111.01 25.98 11.19 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.999 -178.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -63.58 143.96 57.4 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.158 0.504 . . . . 0.0 110.641 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.579 ' ND2' ' HA ' ' A' ' 67' ' ' CYS . 0.3 OUTLIER -135.61 139.14 43.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.862 -177.046 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.498 ' HG ' ' N ' ' A' ' 80' ' ' LEU . 2.5 pt? -59.72 -52.26 66.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.216 -179.357 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.517 ' HG ' ' HB2' ' A' ' 83' ' ' TYR . 12.8 tp -86.93 74.74 9.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.304 0.574 . . . . 0.0 109.934 177.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -72.43 146.69 46.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.714 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.56 -8.94 76.64 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.606 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' TYR . . . . . 0.517 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 47.8 m-85 -123.65 164.84 18.27 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.484 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 12.6 m170 -128.33 146.79 61.08 Favored Pre-proline 0 CA--C 1.509 -0.616 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 172.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' PRO . . . . . 0.539 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 56.5 Cg_endo -75.55 138.47 21.78 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.114 1.876 . . . . 0.0 111.064 172.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.439 ' HD2' ' HD1' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -142.3 153.07 43.58 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.082 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.418 ' CD1' HG12 ' A' ' 96' ' ' ILE . 2.2 mm? -79.21 147.3 32.66 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.882 0.372 . . . . 0.0 110.517 -177.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 25.3 m -131.37 135.63 59.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.633 174.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.1 p -90.38 114.62 28.28 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-O 121.098 0.475 . . . . 0.0 110.832 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -119.38 95.74 4.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.494 178.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.74 -123.93 7.73 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.554 -1.018 . . . . 0.0 110.554 -174.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -103.77 10.44 36.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.957 0.408 . . . . 0.0 110.33 173.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 24.8 m -116.11 135.91 53.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 78.1 mt -101.84 133.44 45.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.385 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.421 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 3.6 t70 -118.0 178.6 4.36 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -177.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.467 HD11 ' O ' ' A' ' 56' ' ' LYS . 53.3 mt -127.31 113.39 31.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 120.705 0.288 . . . . 0.0 110.944 -176.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . 0.539 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 29.8 mm-40 -113.86 -173.89 2.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.01 179.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.484 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 10.3 m-85 -128.82 150.11 50.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.016 0.436 . . . . 0.0 111.926 -177.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.439 ' HD1' ' HD2' ' A' ' 86' ' ' LYS . 53.3 p90 -136.46 158.13 45.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.088 174.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -71.74 132.59 44.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.376 0.608 . . . . 0.0 111.862 -177.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 33.7 t -57.88 122.6 58.52 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.192 173.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.65 -23.14 70.07 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.419 2.079 . . . . 0.0 112.301 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.8 t -64.93 -19.74 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 121.239 0.542 . . . . 0.0 110.823 178.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.641 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.065 178.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ttt . . . . . 0 N--CA 1.485 1.285 0 CA-C-O 121.302 0.572 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 2' ' ' GLU . 0.2 OUTLIER -119.65 88.15 38.65 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.529 -177.666 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.509 ' O ' ' HG3' ' A' ' 6' ' ' ARG . 25.9 Cg_exo -61.11 111.54 1.12 Allowed 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.589 2.193 . . . . 0.0 112.009 -178.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 58.6 mt -74.07 -36.06 43.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.218 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -101.64 59.07 0.62 Allowed Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.782 177.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 3' ' ' PRO . 61.4 mtt85 -58.5 124.56 20.03 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.789 0.328 . . . . 0.0 110.924 178.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.0 m -85.11 -7.56 59.03 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.263 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.2 tt -78.12 68.22 4.11 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 175.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -137.94 111.02 7.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.452 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.44 131.39 13.16 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.424 -175.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.29 140.04 20.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.7 p -67.33 -16.6 64.35 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.061 0.458 . . . . 0.0 111.949 -174.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -82.4 92.17 1.57 Allowed Glycine 0 N--CA 1.442 -0.912 0 C-N-CA 120.741 -0.742 . . . . 0.0 111.87 176.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.446 HH11 ' HD3' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -143.47 79.61 13.75 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 121.866 0.841 . . . . 0.0 111.255 178.028 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.54 ' HG2' ' HB3' ' A' ' 17' ' ' PHE . 62.3 Cg_endo -74.04 177.7 7.85 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.339 2.026 . . . . 0.0 111.138 172.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.639 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 22.0 t70 -60.67 -23.4 64.79 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.223 0.535 . . . . 0.0 109.984 177.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.54 ' HB3' ' HG2' ' A' ' 15' ' ' PRO . 92.0 t80 -52.78 -41.32 64.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.475 175.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -70.36 -29.46 66.14 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -178.297 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.639 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 46.9 mtpt -64.9 -39.8 94.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.943 177.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 23.7 mtp180 -66.17 -48.02 72.09 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 174.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.435 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 32.2 tp -54.32 -50.17 67.99 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.138 -1.392 . . . . 0.0 112.488 -177.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -71.98 -28.86 63.7 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.84 0.353 . . . . 0.0 110.873 -179.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -70.66 -50.3 38.2 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.878 0.37 . . . . 0.0 110.082 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.499 ' O ' HG23 ' A' ' 28' ' ' VAL . 23.1 ptm -67.23 -36.59 81.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.713 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -54.17 -50.57 66.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.115 176.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -68.45 -46.35 70.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.131 178.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.7 mmmt -53.16 -44.77 68.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 24' ' ' MET . 93.4 t -63.62 -42.47 96.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.011 0.434 . . . . 0.0 110.076 177.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 64.5 mtt -81.81 17.7 1.45 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.138 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -118.39 -11.71 9.97 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.066 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.608 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 13.7 t70 -85.44 145.77 27.28 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.86 0.362 . . . . 0.0 110.449 -177.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 65.7 mm-40 -75.46 -35.47 60.88 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.668 -173.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -68.97 -40.41 78.89 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.922 -0.769 . . . . 0.0 108.922 -179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.82 -43.93 85.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 114.613 -1.176 . . . . 0.0 110.834 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.608 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 75.4 mm-40 -56.25 -49.88 72.92 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.242 0.544 . . . . 0.0 110.346 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.45 -49.34 78.16 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.243 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -63.91 -41.95 97.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.222 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.443 HD11 HD11 ' A' ' 50' ' ' ILE . 1.1 mm? -55.52 -51.42 67.07 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.105 -178.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.456 ' HB3' ' HE2' ' A' ' 39' ' ' LYS . 15.5 ptpt -74.67 -24.39 58.79 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.901 0.381 . . . . 0.0 110.99 -177.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -63.79 -46.2 86.29 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.307 0.575 . . . . 0.0 110.378 177.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -114.88 26.45 10.15 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.665 -176.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.412 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 10.8 pt-20 -67.89 -18.19 64.72 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 120.835 0.35 . . . . 0.0 111.501 -176.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -73.45 -26.46 60.95 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.287 0.565 . . . . 0.0 109.794 175.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.7 t -99.2 -42.58 10.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.056 -176.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.4 mt -80.15 144.2 11.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.378 -175.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -114.31 163.31 15.46 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.936 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -55.22 -43.15 74.24 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.309 0.576 . . . . 0.0 111.265 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -69.55 -36.31 76.22 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.287 -178.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 57.8 ttm -56.13 -38.59 71.03 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.529 174.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.443 HD11 HD11 ' A' ' 38' ' ' LEU . 42.6 mm -61.77 -47.25 94.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.988 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 46.3 mt-10 -70.91 -30.62 67.01 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.499 -178.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -70.68 -43.59 68.77 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.671 0.272 . . . . 0.0 110.752 176.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.0 m -92.92 19.61 7.54 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.41 -179.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -51.74 -51.72 54.02 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.13 -179.175 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -52.94 -45.08 67.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.579 -179.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.487 ' O ' HD11 ' A' ' 96' ' ' ILE . 38.3 mmtm -63.68 -53.69 47.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.211 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.1 mp -63.36 -33.58 75.84 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.695 -177.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.401 ' O ' ' HB3' ' A' ' 62' ' ' GLU . 42.9 t80 -73.65 -41.0 63.3 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.871 0.367 . . . . 0.0 110.477 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.449 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 42.1 tt0 -65.88 -33.04 74.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.495 0.664 . . . . 0.0 109.882 177.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -58.71 -51.61 69.24 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.6 177.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 33.0 pt -75.17 -28.25 20.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.876 -176.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.401 ' HB3' ' O ' ' A' ' 58' ' ' TYR . 0.0 OUTLIER -73.83 -33.06 64.0 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.031 -175.327 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 47.5 mt-30 -81.02 179.48 7.84 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.875 0.369 . . . . 0.0 111.145 -178.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.1 t -66.65 117.06 8.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.692 179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.7 tmtt? -75.23 -27.0 59.35 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.394 0.616 . . . . 0.0 110.175 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -102.55 -160.89 0.81 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.41 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -154.46 157.84 39.03 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 177.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.6 t -79.21 -9.83 59.67 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.194 0.521 . . . . 0.0 110.703 -172.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -69.69 -11.56 60.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.211 0.529 . . . . 0.0 110.604 173.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 17.8 p -126.49 -40.33 1.95 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.255 176.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.2 m -99.0 153.44 18.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.1 -179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.44 16.12 6.92 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.229 0.538 . . . . 0.0 110.691 178.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -68.16 86.21 0.26 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.833 176.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -80.41 -11.27 59.71 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.055 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -81.1 -13.42 58.74 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.615 -175.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 66.9 m -87.96 115.53 25.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.516 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -78.06 108.11 11.1 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.245 177.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -120.12 135.63 54.89 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.817 178.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.668 ' HG ' HD22 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -104.29 -35.93 7.8 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 176.166 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.668 HD22 ' HG ' ' A' ' 79' ' ' LEU . 3.2 mm? -87.12 49.19 1.77 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.976 170.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -67.41 147.5 52.81 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.33 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 94.0 -9.03 73.14 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.467 -173.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.42 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 56.2 m-85 -125.0 171.81 9.93 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.452 ' HB2' ' CZ ' ' A' ' 99' ' ' TYR . 16.9 m170 -130.5 147.48 66.11 Favored Pre-proline 0 C--N 1.329 -0.291 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 171.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -76.96 135.49 15.64 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.363 2.042 . . . . 0.0 112.472 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -136.95 146.33 45.27 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 172.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.6 mt -80.72 142.95 33.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.802 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 23.2 m -139.94 141.36 34.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.938 175.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.1 p -93.37 114.68 30.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.498 0.666 . . . . 0.0 110.454 179.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -116.0 96.68 5.69 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.676 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.95 -112.98 4.71 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.665 -177.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.494 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 8.0 mpt_? -106.85 0.9 24.32 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.909 0.385 . . . . 0.0 110.965 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 12.2 p -121.5 147.58 45.59 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.006 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 55.9 mt -103.66 124.57 58.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.956 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -109.77 177.62 4.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.245 0.545 . . . . 0.0 110.839 -175.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.487 HD11 ' O ' ' A' ' 56' ' ' LYS . 47.4 mt -126.53 105.88 14.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.283 -178.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -105.46 150.75 25.02 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.237 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.42 ' CD2' ' HB2' ' A' ' 83' ' ' TYR . 17.2 m-85 -100.17 126.87 46.49 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.056 179.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.452 ' CZ ' ' HB2' ' A' ' 84' ' ' HIS . 54.3 p90 -105.49 144.34 32.39 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 173.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -63.2 138.71 58.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.111 0.481 . . . . 0.0 111.069 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 40.6 t -56.63 123.37 57.0 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.456 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -63.07 -17.15 58.78 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.815 2.343 . . . . 0.0 112.213 -178.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.9 t -69.63 -15.76 19.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.827 178.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -67.75 -22.91 65.2 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 17.1 mmm180 -95.45 126.74 40.96 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.429 176.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? . . . . . 0 C--N 1.318 -0.773 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.022 175.776 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.0 tpt . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 120.861 0.363 . . . . 0.0 110.355 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -127.65 153.13 77.68 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.684 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.58 135.11 37.76 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.52 2.147 . . . . 0.0 112.021 176.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.77 HG22 ' H ' ' A' ' 6' ' ' ARG . 4.3 mp -88.46 135.55 25.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 109.441 -0.578 . . . . 0.0 109.441 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -68.08 -12.41 62.78 Favored Glycine 0 CA--C 1.52 0.382 0 C-N-CA 121.143 -0.551 . . . . 0.0 113.25 -176.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.77 ' H ' HG22 ' A' ' 4' ' ' ILE . 16.5 ptp180 -128.67 102.17 6.46 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.4 0.619 . . . . 0.0 110.2 178.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.1 p -73.38 -18.05 61.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.615 -177.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.435 ' N ' HD12 ' A' ' 8' ' ' LEU . 5.2 mp -74.79 -18.4 60.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.343 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -141.5 -154.64 0.53 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.946 -177.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 91.05 -65.53 2.57 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.454 175.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 5.2 m -108.42 94.6 3.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.609 0.719 . . . . 0.0 111.244 -178.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.3 p -98.38 86.27 3.59 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.678 179.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 149.48 109.91 0.52 Allowed Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.596 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.452 HH11 ' HD2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -154.45 87.53 3.48 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-O 120.709 0.29 . . . . 0.0 110.466 -178.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.444 ' HD2' ' HA ' ' A' ' 14' ' ' ARG . 4.8 Cg_endo -48.02 144.74 11.62 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 123.184 2.59 . . . . 0.0 112.061 178.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.473 ' HA ' ' HG3' ' A' ' 19' ' ' LYS . 2.9 m-20 -76.63 -3.3 37.07 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -171.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -65.16 -54.89 22.82 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.483 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 3.2 pt20 -66.88 -30.23 70.34 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.41 178.145 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.473 ' HG3' ' HA ' ' A' ' 16' ' ' ASP . 5.9 mmmm -57.98 -48.41 80.06 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 174.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.422 ' O ' ' HG2' ' A' ' 24' ' ' MET . 2.6 tpp180 -66.57 -45.2 80.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.385 177.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.483 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 26.8 tp -53.94 -49.42 68.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.319 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -67.02 -40.36 87.24 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.922 177.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 27.3 tt0 -59.29 -51.33 70.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.827 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.426 ' O ' HG23 ' A' ' 28' ' ' VAL . 18.1 ptm -73.55 -37.37 65.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.078 -178.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.496 ' HE2' ' HG2' ' A' ' 51' ' ' GLU . 4.5 tppp? -59.76 -40.51 88.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 110.143 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.68 -50.53 70.78 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.323 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -58.14 -47.0 84.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.524 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.529 ' HA ' HD13 ' A' ' 61' ' ' ILE . 74.8 t -62.66 -42.23 95.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.063 -177.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 24.3 mmt -82.98 15.52 2.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.751 0.31 . . . . 0.0 111.279 -178.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -107.27 -20.38 13.3 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.083 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.689 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 35.1 t70 -77.37 131.36 38.02 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.937 0.399 . . . . 0.0 111.237 -175.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -59.45 -45.61 91.12 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.808 -177.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -67.56 -39.43 84.93 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.423 -177.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.8 t -54.83 -49.61 68.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.661 174.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.689 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 36.0 mt-30 -64.38 -40.41 95.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.232 0.539 . . . . 0.0 110.607 -178.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.429 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -59.77 -38.85 82.98 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.33 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.505 ' CZ ' HG23 ' A' ' 89' ' ' VAL . 59.3 t80 -69.82 -44.26 70.33 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.735 177.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.553 HD11 HD11 ' A' ' 50' ' ' ILE . 1.2 mm? -54.41 -47.91 72.23 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.355 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.6 pttt -76.11 -27.06 56.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.028 0.442 . . . . 0.0 111.114 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 5.3 tp10 -65.57 -42.45 91.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.134 0.492 . . . . 0.0 110.124 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -116.01 27.67 9.11 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.161 -176.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -66.94 -16.1 64.11 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.971 0.415 . . . . 0.0 111.734 -175.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -77.85 -19.41 54.91 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.109 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 40.4 t -113.68 -40.74 3.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.992 -176.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.537 ' CG1' HG21 ' A' ' 89' ' ' VAL . 62.4 mt -72.09 141.92 15.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.499 -176.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -115.48 164.1 14.78 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.461 -0.79 . . . . 0.0 108.87 178.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -59.92 -40.19 88.01 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -64.88 -38.17 90.08 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.648 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.6 tpp -58.73 -41.75 87.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.325 177.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.553 HD11 HD11 ' A' ' 38' ' ' LEU . 44.6 mm -61.95 -45.81 97.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.856 178.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.761 ' HA ' HD23 ' A' ' 54' ' ' LEU . 34.2 mt-10 -70.35 -33.85 71.95 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.126 -178.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 58.4 tptt -64.07 -41.52 97.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.125 0.488 . . . . 0.0 110.123 177.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.4 m -107.18 27.46 9.02 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.087 -177.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.761 HD23 ' HA ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -55.29 -46.21 76.21 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-O 121.151 0.501 . . . . 0.0 110.024 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -63.72 -29.64 70.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.017 -176.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.471 ' O ' HD11 ' A' ' 96' ' ' ILE . 65.0 mmtt -68.19 -53.98 21.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.092 0.473 . . . . 0.0 110.103 177.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.2 mp -65.63 -36.74 84.58 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.724 -178.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -65.83 -42.16 90.87 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.18 -0.463 . . . . 0.0 109.898 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -58.07 -48.21 80.84 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.619 175.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.404 ' HD1' ' HB2' ' A' ' 85' ' ' PRO . 51.5 t80 -56.13 -49.26 74.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.47 -177.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.529 HD13 ' HA ' ' A' ' 28' ' ' VAL . 29.7 pt -75.13 -29.55 21.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -174.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -80.39 -30.69 37.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.661 0.267 . . . . 0.0 111.3 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -77.91 -171.78 2.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.159 0.504 . . . . 0.0 110.926 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 31.6 p -74.38 94.03 2.49 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.463 177.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -64.45 -32.93 74.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.614 0.721 . . . . 0.0 109.399 173.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.477 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.0 t-20 -92.22 -159.93 0.7 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.128 179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.486 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -153.95 149.57 27.41 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.447 175.604 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.49 ' HA ' ' O ' ' A' ' 71' ' ' SER . 13.7 t -75.21 0.65 15.73 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.322 -0.854 . . . . 0.0 110.82 -173.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.446 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 5.3 t80 -82.41 -12.68 57.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.199 176.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.477 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 25.6 p -127.53 -40.81 1.75 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.57 178.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.49 ' O ' ' HA ' ' A' ' 68' ' ' SER . 50.2 p -98.34 149.29 22.78 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 174.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 72' ' ' GLU . 14.9 tt0 -102.35 -2.93 27.93 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.879 -0.328 . . . . 0.0 110.782 -176.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.578 ' HB2' HD22 ' A' ' 75' ' ' ASN . 1.8 p30 -58.33 133.25 55.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.469 0.652 . . . . 0.0 110.557 -176.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -94.76 5.44 51.86 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.334 178.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.578 HD22 ' HB2' ' A' ' 73' ' ' ASP . 53.2 m-80 -68.55 -39.74 80.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.889 -177.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 21.8 p -110.44 114.56 28.09 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.965 0.412 . . . . 0.0 110.181 176.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -74.86 107.47 6.97 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.676 0.751 . . . . 0.0 109.908 178.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.707 ' OD1' ' HA ' ' A' ' 81' ' ' GLU . 2.9 t-20 -87.98 103.75 15.98 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.772 -176.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 mp -65.53 -65.53 0.66 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.63 -1.168 . . . . 0.0 110.251 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.2 mp -80.4 77.14 7.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.348 174.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.707 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 29.8 tt0 -73.95 132.54 42.54 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.598 -175.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.14 -7.53 48.13 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.357 -176.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -122.29 162.91 20.61 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.3 m170 -126.04 147.22 58.49 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 169.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.404 ' HB2' ' HD1' ' A' ' 60' ' ' TYR . 46.2 Cg_endo -71.78 136.79 28.52 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.315 2.01 . . . . 0.0 112.358 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.476 ' HB3' ' CD1' ' A' ' 99' ' ' TYR . 20.6 ptmt -128.11 131.72 49.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.416 179.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 76.2 mt -78.92 134.66 36.86 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.177 179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.2 m -132.18 139.68 49.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.121 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.537 HG21 ' CG1' ' A' ' 45' ' ' ILE . 78.8 t -88.98 114.67 27.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-O 121.405 0.621 . . . . 0.0 109.673 175.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -117.05 95.32 4.94 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.133 -172.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.17 -113.94 6.29 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.062 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.526 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 0.2 OUTLIER -105.7 18.34 22.32 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.752 0.31 . . . . 0.0 111.386 179.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.3 m -138.98 167.62 21.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.09 177.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 76.2 mt -114.68 131.71 66.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 174.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -115.62 177.57 4.62 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 -176.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.471 HD11 ' O ' ' A' ' 56' ' ' LYS . 51.0 mt -132.98 108.88 13.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.285 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -99.55 -174.93 2.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.809 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 30.1 m-85 -133.37 124.26 26.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.927 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.476 ' CD1' ' HB3' ' A' ' 86' ' ' LYS . 55.2 p90 -107.22 152.12 24.52 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 100' ' ' GLU . 0.6 OUTLIER -74.14 130.29 39.49 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.417 0.627 . . . . 0.0 110.616 -175.876 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.41 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 48.9 t -46.31 122.88 6.75 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 114.642 -1.163 . . . . 0.0 110.587 174.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 14.7 Cg_endo -60.51 -9.58 11.45 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 123.132 2.555 . . . . 0.0 113.099 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 91.8 t -78.44 -25.23 13.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.639 177.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -65.83 -41.28 91.98 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -135.47 87.95 2.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.126 172.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.2 ttpp . . . . . 0 C--N 1.321 -0.664 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.78 -179.09 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.0 mtp . . . . . 0 N--CA 1.479 0.977 0 CA-C-O 121.052 0.454 . . . . 0.0 109.907 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -102.29 148.55 35.59 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.64 -174.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -74.9 158.4 42.61 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.484 2.123 . . . . 0.0 112.018 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.0 tp -73.74 128.33 36.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.177 0.513 . . . . 0.0 110.746 -178.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.443 ' C ' ' HD2' ' A' ' 6' ' ' ARG . . . -88.07 -134.09 4.49 Favored Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.293 -179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.621 ' HB3' ' HG ' ' A' ' 8' ' ' LEU . 3.8 mpt_? -124.26 162.54 23.51 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.916 0.388 . . . . 0.0 110.714 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.2 m -77.62 -13.31 59.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.805 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.621 ' HG ' ' HB3' ' A' ' 6' ' ' ARG . 2.8 pp -82.47 9.71 8.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.351 -179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -55.01 -44.71 74.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.173 -177.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -114.35 36.61 3.9 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.364 -0.922 . . . . 0.0 113.171 -174.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.408 HG22 ' HA ' ' A' ' 8' ' ' LEU . 29.9 m -131.71 164.57 34.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.853 0.326 . . . . 0.0 110.389 177.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.4 t -79.39 39.87 0.41 Allowed 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.773 0.797 . . . . 0.0 110.662 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -112.42 25.75 11.91 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.091 -179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -149.58 85.73 5.64 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-O 121.321 0.582 . . . . 0.0 110.713 178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -56.52 168.93 1.9 Allowed 'Trans proline' 0 C--O 1.237 0.461 0 C-N-CA 123.881 3.054 . . . . 0.0 113.929 -176.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -57.93 -23.78 54.96 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.726 -178.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -52.46 -46.97 66.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.2 177.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.423 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -71.43 -30.06 65.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.243 0.544 . . . . 0.0 110.04 -177.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.0 mmtm -71.13 -42.54 69.08 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.382 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -72.52 -32.26 65.99 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.751 0.31 . . . . 0.0 110.577 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.8 tp -65.22 -49.48 69.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.388 177.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.582 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 7.0 mm-40 -73.18 -25.0 60.62 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.923 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -61.96 -56.91 14.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.759 0.314 . . . . 0.0 111.398 174.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.533 ' O ' HG23 ' A' ' 28' ' ' VAL . 23.7 ptm -61.14 -35.56 77.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.956 0.407 . . . . 0.0 109.995 176.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.582 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 4.1 tptm -57.78 -46.18 84.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.923 173.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -53.11 -49.25 66.87 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 123.665 0.786 . . . . 0.0 111.103 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.5 mmmm -59.02 -49.42 77.97 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.783 177.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 24' ' ' MET . 57.6 t -64.18 -41.24 91.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.723 -175.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 14.8 ptp -73.73 -4.72 36.23 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 -171.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -127.62 -4.08 5.95 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -177.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.484 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 0.3 OUTLIER -77.38 126.74 31.39 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.179 0.514 . . . . 0.0 110.239 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -66.68 -33.01 74.7 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.972 -168.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -66.46 -41.23 89.37 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.789 0.328 . . . . 0.0 110.236 177.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 91.3 t -58.28 -44.82 88.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.289 172.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 84.4 mm-40 -55.38 -50.47 69.64 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.922 178.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -54.67 -42.62 71.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.26 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -68.85 -43.44 75.45 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.692 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.712 HD11 HD11 ' A' ' 50' ' ' ILE . 2.4 mm? -61.03 -44.7 97.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.445 -178.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.419 ' HE2' ' HB2' ' A' ' 39' ' ' LYS . 4.1 ptmm? -70.83 -26.05 63.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.045 0.45 . . . . 0.0 110.508 -179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -73.85 -44.23 56.16 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.974 0.416 . . . . 0.0 110.588 -178.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -112.74 29.02 8.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.505 -176.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -64.22 -22.54 66.98 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.031 0.444 . . . . 0.0 111.354 -176.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -75.11 -25.99 58.91 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.534 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 25.5 t -101.07 -42.37 9.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.99 -174.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.531 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 65.3 mt -77.87 142.63 13.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.794 -175.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -118.24 165.7 13.5 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.707 176.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -55.68 -44.33 77.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.901 177.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.406 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 51.6 mtpt -66.14 -36.89 84.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.086 0.469 . . . . 0.0 110.706 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.531 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 23.0 ttt -60.13 -35.83 76.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.201 177.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.712 HD11 HD11 ' A' ' 38' ' ' LEU . 37.0 mm -64.57 -54.45 30.24 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.839 176.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.516 ' HA ' HD23 ' A' ' 54' ' ' LEU . 7.7 mm-40 -57.53 -42.18 82.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.024 0.44 . . . . 0.0 111.014 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -65.36 -29.73 70.49 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.082 -178.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.447 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 7.3 m -114.26 20.5 15.49 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.38 -178.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.516 HD23 ' HA ' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -58.88 -44.7 91.19 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.922 -177.633 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -60.6 -33.67 73.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.782 178.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.574 ' O ' HD11 ' A' ' 96' ' ' ILE . 32.1 mmmt -73.22 -42.76 62.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.818 0.342 . . . . 0.0 110.91 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.446 HD21 HG21 ' A' ' 94' ' ' ILE . 76.2 mt -65.51 -38.79 90.71 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.143 0.497 . . . . 0.0 110.132 177.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -70.3 -39.26 74.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.115 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.523 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 38.0 tt0 -57.21 -39.72 76.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.012 175.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -59.51 -52.21 66.55 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.525 177.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.7 pt -74.34 -29.0 23.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -174.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.523 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 7.6 pt-20 -75.63 -20.73 58.31 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.811 178.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 46.3 mt-30 -74.36 -167.15 0.49 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.925 0.393 . . . . 0.0 110.322 174.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.561 ' HB2' ' C ' ' A' ' 77' ' ' ASN . 20.0 t -83.74 130.16 34.95 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.881 0.372 . . . . 0.0 111.212 -177.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -73.05 -26.6 61.35 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.533 0.682 . . . . 0.0 109.574 173.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.487 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 76.6 m-20 -122.78 -160.09 0.87 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.608 -177.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.435 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 6.8 p -152.63 161.11 43.01 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 176.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.606 ' HB3' ' HG3' ' A' ' 81' ' ' GLU . 48.1 t -60.24 -29.22 68.63 Favored 'General case' 0 C--N 1.319 -0.739 0 O-C-N 123.49 0.494 . . . . 0.0 111.285 -174.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -72.37 -1.92 17.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.032 0.444 . . . . 0.0 111.617 -178.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.9 p -136.31 6.94 3.08 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.591 175.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 38.5 t -145.35 118.65 8.96 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.865 0.364 . . . . 0.0 110.302 -176.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -81.81 -6.69 59.29 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.03 177.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -79.73 134.13 36.37 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.019 -174.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -64.28 -26.4 68.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.079 -0.51 . . . . 0.0 112.328 -176.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -81.49 67.45 7.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.824 0.821 . . . . 0.0 110.238 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.451 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 15.7 p -115.51 116.92 29.0 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.454 172.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.561 ' C ' ' HB2' ' A' ' 64' ' ' SER . 56.4 m-20 -79.08 21.81 0.43 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.653 -173.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.454 ' N ' ' HB2' ' A' ' 64' ' ' SER . 3.0 p-10 -103.66 128.06 51.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.153 0.501 . . . . 0.0 111.272 -177.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.868 ' HG ' HD12 ' A' ' 80' ' ' LEU . 0.7 OUTLIER -90.73 -26.89 19.29 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 168.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.868 HD12 ' HG ' ' A' ' 79' ' ' LEU . 5.5 mp -85.51 110.3 19.1 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.258 173.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.606 ' HG3' ' HB3' ' A' ' 68' ' ' SER . 33.5 tt0 -88.48 142.05 28.03 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.091 0.472 . . . . 0.0 110.541 -179.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.2 -8.78 77.44 Favored Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.657 -0.701 . . . . 0.0 112.887 176.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -126.43 160.3 30.89 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.919 0.359 . . . . 0.0 110.989 -177.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.487 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 13.1 m170 -128.07 149.32 70.67 Favored Pre-proline 0 C--O 1.236 0.345 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.005 177.157 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -78.98 153.54 25.33 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.548 2.166 . . . . 0.0 112.166 178.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -152.6 151.96 31.25 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 175.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -82.57 142.65 31.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.964 0.411 . . . . 0.0 110.346 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.493 ' CG2' ' HB3' ' A' ' 95' ' ' ASP . 33.1 m -132.49 155.42 41.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.622 176.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.42 HG23 ' CE ' ' A' ' 49' ' ' MET . 4.3 p -99.92 115.15 40.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-O 121.168 0.508 . . . . 0.0 110.08 175.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -120.17 95.82 4.9 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.866 177.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.64 -124.11 28.41 Favored Glycine 0 N--CA 1.45 -0.425 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.088 -177.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -96.59 13.9 26.61 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.83 0.348 . . . . 0.0 111.0 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 14.5 m -125.24 144.42 50.47 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.663 -178.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.447 ' HB ' ' CB ' ' A' ' 53' ' ' SER . 60.8 mt -97.56 131.78 43.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 174.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.493 ' HB3' ' CG2' ' A' ' 88' ' ' VAL . 41.3 t0 -126.46 178.08 6.08 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.745 0.307 . . . . 0.0 110.254 -170.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.574 HD11 ' O ' ' A' ' 56' ' ' LYS . 77.0 mt -124.39 129.94 73.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-O 121.249 0.547 . . . . 0.0 110.273 179.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -122.49 172.33 8.44 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.283 177.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -124.42 134.99 52.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.008 0.432 . . . . 0.0 111.268 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.7 p90 -118.21 151.2 38.08 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.588 ' HG2' ' HD3' ' A' ' 104' ' ' LYS . 24.4 tt0 -71.84 137.19 47.36 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.979 0.419 . . . . 0.0 110.582 -175.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.443 ' SG ' HG12 ' A' ' 103' ' ' VAL . 19.8 t -47.58 124.8 9.8 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.505 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.37 -10.91 25.74 Favored 'Trans proline' 0 N--CA 1.474 0.337 0 C-N-CA 123.198 2.599 . . . . 0.0 113.493 -176.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.443 HG12 ' SG ' ' A' ' 101' ' ' CYS . 9.8 p -66.61 -19.39 25.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.282 0.563 . . . . 0.0 110.306 179.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.588 ' HD3' ' HG2' ' A' ' 100' ' ' GLU . 8.3 mtpm? -80.86 -10.08 59.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.219 -178.053 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 38.2 ttm-85 -136.43 90.44 2.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.853 0.359 . . . . 0.0 110.094 174.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.459 -179.938 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 N--CA 1.483 1.179 0 CA-C-O 120.892 0.377 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -116.32 87.34 19.78 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.277 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -70.38 97.59 0.7 Allowed 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.303 2.002 . . . . 0.0 112.025 -178.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.5 mm -107.69 -43.5 6.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.113 178.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -91.02 144.24 17.1 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.056 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 59.8 mtm180 -103.73 145.83 29.5 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.669 0.271 . . . . 0.0 110.317 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 22.4 m -74.9 80.63 2.15 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.311 0.576 . . . . 0.0 111.332 -178.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 33.3 tp -101.53 6.6 42.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.59 0.71 . . . . 0.0 109.848 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -100.42 111.89 24.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.054 -178.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -127.17 41.77 1.56 Allowed Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.14 177.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.435 HG12 ' H ' ' A' ' 13' ' ' GLY . 26.4 t -100.34 148.62 6.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.414 -0.393 . . . . 0.0 110.242 -176.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.3 t -78.02 12.05 1.98 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.45 0.643 . . . . 0.0 110.94 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.435 ' H ' HG12 ' A' ' 11' ' ' VAL . . . -119.36 125.72 6.47 Favored Glycine 0 N--CA 1.447 -0.611 0 N-CA-C 111.19 -0.764 . . . . 0.0 111.19 177.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -142.61 79.65 15.02 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 117.03 0.415 . . . . 0.0 110.853 -176.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -69.85 114.42 3.71 Favored 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.613 2.209 . . . . 0.0 111.701 173.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -71.5 -32.46 68.25 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.518 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -52.17 -47.64 65.39 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.537 -179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.409 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 1.7 pt20 -68.88 -30.75 69.32 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.208 -175.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 30.3 mmtm -72.13 -38.16 69.32 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -175.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.405 ' HD2' HH11 ' A' ' 20' ' ' ARG . 19.1 ptt85 -75.52 -23.78 56.73 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.444 176.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 27.4 tp -70.48 -48.57 55.12 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.12 174.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 18' ' ' GLN . 37.0 mt-10 -58.92 -43.2 91.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.884 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -58.29 -53.71 55.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.999 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.629 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.3 ptm -68.68 -42.3 78.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.287 -177.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -61.25 -43.06 99.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.719 0.295 . . . . 0.0 110.777 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -64.88 -46.4 81.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.059 0.457 . . . . 0.0 110.173 179.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -55.75 -45.39 78.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.949 178.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 24' ' ' MET . 74.3 t -62.08 -37.54 78.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.939 0.4 . . . . 0.0 110.79 -179.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.8 mtp -82.3 -2.97 54.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.59 -178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -103.8 -6.57 21.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.305 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.413 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 26.1 t70 -77.93 137.61 38.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.824 0.345 . . . . 0.0 110.489 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -67.57 -43.47 80.52 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.483 -175.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -70.42 -43.67 69.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.53 -177.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 54.9 t -54.99 -55.18 17.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.855 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 2.1 pt20 -65.61 -34.21 77.7 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -176.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.91 -41.61 86.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.265 0.555 . . . . 0.0 110.192 175.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.507 ' HZ ' HG23 ' A' ' 89' ' ' VAL . 88.4 t80 -61.8 -38.94 89.99 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.228 -0.896 . . . . 0.0 110.812 176.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.82 HD11 HD11 ' A' ' 50' ' ' ILE . 1.6 mm? -61.25 -50.47 72.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.794 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -70.0 -23.1 63.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.025 0.44 . . . . 0.0 111.054 -177.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -76.15 -37.52 57.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.958 176.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -110.71 25.18 12.06 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.701 -174.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -63.67 -20.78 65.98 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.076 0.465 . . . . 0.0 111.311 -176.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -75.5 -20.44 58.75 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.574 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.4 t -108.06 -46.98 7.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.802 -176.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.458 HD11 HG21 ' A' ' 89' ' ' VAL . 54.6 mt -81.33 144.16 10.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.979 -173.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.494 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.5 OUTLIER -130.83 -178.65 4.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.442 176.454 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -64.36 -42.25 96.31 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -60.03 -44.79 94.39 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.589 0.233 . . . . 0.0 110.609 177.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.421 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 38.5 ttm -56.25 -38.95 71.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.537 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.82 HD11 HD11 ' A' ' 38' ' ' LEU . 46.1 mm -60.52 -54.12 39.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.945 177.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -62.09 -38.11 87.63 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.129 0.49 . . . . 0.0 111.068 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -69.68 -26.46 64.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.608 -178.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 77.3 p -114.37 16.48 17.82 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.265 -177.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.94 -42.68 69.09 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 121.456 0.646 . . . . 0.0 110.508 178.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.519 ' O ' ' HG2' ' A' ' 59' ' ' GLU . 24.4 p-10 -59.67 -44.46 93.59 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.738 177.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.589 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.1 mmmt -67.48 -49.94 61.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.557 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 87.3 mt -56.6 -41.07 76.39 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.531 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -67.39 -42.77 82.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.072 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 55' ' ' ASN . 15.9 mm-40 -58.87 -39.36 81.12 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-O 120.9 0.381 . . . . 0.0 110.763 177.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 68.4 t80 -58.88 -51.33 70.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.531 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.6 pt -71.64 -29.69 35.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.702 -174.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -75.75 -23.25 55.97 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.014 0.435 . . . . 0.0 111.093 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 46.9 mt-30 -80.26 167.75 19.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.048 178.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.2 m -66.9 113.4 4.92 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.52 -178.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 64.3 tttp -64.83 -26.19 68.23 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.781 172.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.7 p-10 -102.19 -163.18 0.98 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.664 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.7 p -159.6 158.04 30.9 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.0 m -67.32 -25.4 66.0 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 121.067 0.461 . . . . 0.0 110.775 -172.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 104' ' ' LYS . 1.3 t80 -67.76 -5.89 18.43 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.57 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 28.7 p -135.92 2.63 2.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.749 0.309 . . . . 0.0 111.1 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 45.8 m -124.33 145.27 49.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.898 0.38 . . . . 0.0 110.16 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -77.26 -13.55 59.92 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.271 0.557 . . . . 0.0 110.844 -175.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.552 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 0.3 OUTLIER -80.13 87.06 5.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.435 179.561 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -68.37 -11.13 59.11 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.583 0.706 . . . . 0.0 110.151 175.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -73.71 -17.58 61.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.218 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.552 ' SG ' ' HB3' ' A' ' 73' ' ' ASP . 59.8 m -71.27 117.4 12.76 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.892 0.377 . . . . 0.0 111.023 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -87.31 99.83 12.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.996 0.427 . . . . 0.0 110.007 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -102.05 129.75 48.44 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.499 -177.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.596 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.5 pt? -66.9 -24.35 66.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.415 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.485 HD12 ' HG ' ' A' ' 79' ' ' LEU . 5.3 mp -141.96 103.84 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 174.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.0 tp10 -94.69 150.49 20.17 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 -176.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.52 -9.41 77.18 Favored Glycine 0 N--CA 1.444 -0.826 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.389 -174.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -124.18 166.99 14.88 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 99' ' ' TYR . 16.7 m170 -127.62 146.84 60.12 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 169.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.3 145.77 39.13 Favored 'Trans proline' 0 N--CA 1.455 -0.739 0 C-N-CA 122.063 1.842 . . . . 0.0 111.513 175.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -142.03 149.63 40.24 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.096 177.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.7 mt -83.59 135.59 34.56 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.058 177.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.478 HG11 ' HG3' ' A' ' 97' ' ' GLU . 29.7 m -133.81 150.63 31.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 175.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.616 HG22 HG12 ' A' ' 94' ' ' ILE . 48.4 t -109.84 112.67 41.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.341 0.591 . . . . 0.0 109.499 172.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -108.87 104.07 13.25 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.798 -177.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.74 -105.03 1.42 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.833 -0.699 . . . . 0.0 111.525 -177.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -117.21 5.06 12.65 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.737 0.303 . . . . 0.0 110.575 178.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.6 p -122.29 138.02 54.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.789 0.328 . . . . 0.0 111.392 -176.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.616 HG12 HG22 ' A' ' 89' ' ' VAL . 66.1 mt -90.53 137.52 21.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.848 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -134.38 178.86 6.65 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.808 0.337 . . . . 0.0 110.774 -176.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.589 HD11 ' O ' ' A' ' 56' ' ' LYS . 51.8 mt -123.49 110.61 26.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.354 -177.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.478 ' HG3' HG11 ' A' ' 88' ' ' VAL . 7.0 mm-40 -102.83 179.45 4.28 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.24 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -128.25 133.56 48.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.586 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.416 ' CZ ' ' HB2' ' A' ' 84' ' ' HIS . 52.1 p90 -115.91 140.59 49.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.007 174.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -56.82 127.11 30.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.906 178.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 49.2 t -52.71 122.31 26.4 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.792 175.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -63.02 -1.12 2.56 Favored 'Trans proline' 0 N--CA 1.476 0.494 0 C-N-CA 123.37 2.713 . . . . 0.0 113.432 -176.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.8 t -79.83 -44.3 23.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.412 175.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.513 ' HB3' ' CE2' ' A' ' 69' ' ' TYR . 14.7 ptmm? -82.3 -21.81 35.96 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.853 0.359 . . . . 0.0 110.874 -178.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 43.6 ttm105 -139.51 99.86 3.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.107 0.48 . . . . 0.0 109.954 174.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.4 tttm . . . . . 0 C--N 1.319 -0.722 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.395 -178.143 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.2 tpt . . . . . 0 N--CA 1.478 0.952 0 CA-C-O 120.931 0.396 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -96.09 156.5 37.01 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.725 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.09 91.4 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.455 2.104 . . . . 0.0 111.432 175.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 68.1 mt -125.4 116.06 45.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.453 -177.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 98.9 137.74 9.96 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.823 177.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 21.2 tpp85 -109.91 107.47 17.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.935 0.398 . . . . 0.0 110.289 176.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 21.1 t -140.76 141.75 34.8 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.209 179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.505 ' O ' HD13 ' A' ' 8' ' ' LEU . 2.0 tm? -73.36 -27.16 61.34 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 177.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -83.77 42.1 0.83 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.544 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -77.76 67.69 2.88 Favored Glycine 0 N--CA 1.451 -0.341 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.431 -177.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 45.1 t -91.78 94.23 4.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 175.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.1 m -73.89 97.1 2.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.769 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 80.95 138.5 2.26 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.74 177.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.447 ' HD3' ' N ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -155.04 78.62 4.77 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 121.449 0.642 . . . . 0.0 110.383 175.839 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -67.95 155.73 68.6 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.374 2.049 . . . . 0.0 112.16 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.423 ' OD2' ' HD2' ' A' ' 20' ' ' ARG . 16.2 t70 -53.2 -32.37 47.66 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.278 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -53.74 -56.12 20.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.17 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -72.11 -30.64 65.28 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.208 -176.818 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 25.8 mmmt -67.56 -46.5 72.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.475 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.495 ' O ' ' HG2' ' A' ' 24' ' ' MET . 11.4 ptm180 -71.15 -26.59 63.06 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 178.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.0 tp -68.69 -48.82 62.93 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.973 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 11.6 pt-20 -70.77 -30.58 67.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.75 0.309 . . . . 0.0 110.59 175.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 7.6 tt0 -64.73 -53.89 40.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.697 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.495 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 12.0 ptp -61.79 -38.65 88.89 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.464 178.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 29' ' ' MET . 4.3 tppp? -56.15 -50.26 71.64 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.323 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.24 -49.93 75.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.635 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -52.01 -51.84 54.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.773 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.456 ' CG1' HG11 ' A' ' 34' ' ' VAL . 84.7 t -62.8 -34.42 65.68 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.326 -177.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.7 mmt -73.74 -8.93 57.92 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.452 -179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -102.94 -8.64 20.51 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 -176.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -85.28 131.15 34.46 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.391 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -63.36 -42.06 98.86 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.152 -178.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -68.99 -45.4 70.69 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.018 0.437 . . . . 0.0 110.438 -175.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.456 HG11 ' CG1' ' A' ' 28' ' ' VAL . 44.7 t -56.85 -55.41 20.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.534 178.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -65.3 -31.64 72.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.799 0.333 . . . . 0.0 111.447 -176.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.2 -42.34 88.94 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.977 0.418 . . . . 0.0 110.526 174.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -65.75 -37.57 86.72 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.734 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.3 mm? -57.85 -44.89 86.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.242 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.04 -24.21 40.89 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.77 0.319 . . . . 0.0 110.681 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.88 -49.89 73.07 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.313 0.578 . . . . 0.0 110.343 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -115.62 31.42 6.72 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.273 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -60.88 -23.41 65.16 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -175.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -85.13 -25.45 27.47 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.222 0.535 . . . . 0.0 110.661 -179.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 32.4 t -96.12 -40.83 11.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.117 -174.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.7 mt -70.53 140.54 18.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.836 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.425 ' HB2' ' H ' ' A' ' 49' ' ' MET . 16.5 m-20 -91.92 151.02 20.72 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.53 176.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -61.4 -36.28 79.86 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 172.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -63.61 -43.06 98.0 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.321 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.425 ' H ' ' HB2' ' A' ' 46' ' ' ASP . 45.2 ttm -55.63 -37.87 68.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.9 178.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.6 mm -63.24 -49.11 84.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.866 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -58.47 -38.04 76.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.264 0.554 . . . . 0.0 110.777 178.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -77.68 -29.96 51.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.476 -176.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 m -106.06 11.68 31.21 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -174.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.8 tp -57.33 -38.1 73.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.867 0.365 . . . . 0.0 110.656 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -60.21 -39.43 86.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.089 177.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -69.9 -43.02 72.59 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.966 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.429 ' O ' HG23 ' A' ' 61' ' ' ILE . 10.8 mp -61.89 -40.63 96.08 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.351 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.48 ' O ' HG12 ' A' ' 61' ' ' ILE . 13.3 t80 -66.88 -44.17 81.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.993 178.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.11 -45.33 91.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.383 0.611 . . . . 0.0 110.064 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -58.79 -40.26 83.52 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.595 -178.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.52 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 23.4 pt -75.55 -30.11 21.62 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.551 -176.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -83.79 -22.76 31.73 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.785 0.326 . . . . 0.0 111.081 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -105.21 145.01 31.2 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 -172.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.593 ' HB3' ' HG3' ' A' ' 85' ' ' PRO . 25.6 t 53.33 34.72 18.53 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 160.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.52 ' HE2' ' HA ' ' A' ' 61' ' ' ILE . 52.8 mmtt -63.02 -26.07 68.68 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.918 -0.489 . . . . 0.0 111.347 -179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -131.59 -166.95 1.79 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.042 0.448 . . . . 0.0 110.328 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.8 p -158.13 161.42 37.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 176.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.9 p -62.81 -26.68 68.86 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.221 0.534 . . . . 0.0 112.398 -171.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.462 ' CE2' ' HA ' ' A' ' 104' ' ' LYS . 1.2 t80 -69.0 -16.66 63.78 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.753 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.467 ' HB3' HG21 ' A' ' 103' ' ' VAL . 25.8 p -124.8 5.71 8.1 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.445 -0.502 . . . . 0.0 111.81 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 m -137.16 152.72 50.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 110.286 -0.264 . . . . 0.0 110.286 179.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -82.03 -20.03 39.19 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.49 105.39 0.52 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.016 173.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -80.09 -13.39 59.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.223 0.535 . . . . 0.0 110.776 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -87.1 74.61 9.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.471 178.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 36.2 m -86.47 139.29 31.03 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.672 -176.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -92.26 37.7 0.99 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 171.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 39.3 t-20 -115.26 138.2 51.2 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.176 -172.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.4 mp -80.14 -68.57 0.66 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.423 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.424 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 7.4 mp -85.49 100.83 12.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.876 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -63.68 139.5 58.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.125 0.488 . . . . 0.0 110.698 -179.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.87 -8.69 79.0 Favored Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.454 -176.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.409 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 16.3 m-85 -121.96 168.87 11.4 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 122.248 0.219 . . . . 0.0 110.516 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -131.97 153.72 81.48 Favored Pre-proline 0 C--N 1.327 -0.376 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 173.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.593 ' HG3' ' HB3' ' A' ' 64' ' ' SER . 93.9 Cg_endo -79.0 151.15 23.8 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 122.638 2.226 . . . . 0.0 112.085 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.408 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 61.9 tttp -147.85 137.36 22.44 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.645 176.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.402 HD23 HG12 ' A' ' 96' ' ' ILE . 90.9 mt -68.4 131.76 45.87 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.326 178.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 18.7 m -135.8 149.92 28.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 116.09 -0.504 . . . . 0.0 109.798 178.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 4.9 p -104.33 116.75 48.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.386 0.612 . . . . 0.0 110.765 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -112.91 99.0 7.54 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.445 176.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.75 -118.36 6.07 Favored Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.698 -0.763 . . . . 0.0 111.432 -175.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 34.8 mmt180 -111.12 14.17 21.85 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.922 0.392 . . . . 0.0 110.663 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 17.6 p -122.26 141.9 51.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.677 176.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 84.1 mt -97.53 130.21 46.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.962 0.411 . . . . 0.0 110.32 -179.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -118.12 175.3 5.75 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.427 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.402 HG12 HD23 ' A' ' 87' ' ' LEU . 58.1 mt -128.14 98.06 4.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.787 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -103.91 -175.86 2.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.718 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.424 ' CD2' ' HB2' ' A' ' 80' ' ' LEU . 9.1 m-85 -123.8 138.48 54.5 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -171.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.408 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 12.4 p90 -115.06 157.45 23.5 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 170.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -73.69 142.71 46.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.808 0.337 . . . . 0.0 111.613 -175.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 43.7 t -60.55 122.77 70.27 Favored Pre-proline 0 C--N 1.333 -0.135 0 CA-C-N 115.936 -0.574 . . . . 0.0 109.563 177.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -58.72 -17.03 33.76 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.995 2.463 . . . . 0.0 112.761 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.467 HG21 ' HB3' ' A' ' 70' ' ' CYS . 93.0 t -66.49 -16.85 21.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.953 175.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.462 ' HA ' ' CE2' ' A' ' 69' ' ' TYR . 36.7 ttpt -68.08 -16.84 64.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.313 0.578 . . . . 0.0 109.829 177.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 9.0 tpm_? -94.18 88.82 5.74 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.469 174.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm . . . . . 0 C--N 1.322 -0.587 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.97 179.485 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.6 tpt . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 121.232 0.539 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.421 ' HA ' ' HD2' ' A' ' 3' ' ' PRO . 3.3 mp0 -116.29 88.3 22.69 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.446 -174.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 2' ' ' GLU . 18.1 Cg_endo -58.73 141.83 98.13 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.714 2.276 . . . . 0.0 112.048 -178.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 62.1 mt -95.15 94.4 4.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -167.9 35.1 0.21 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.502 -0.856 . . . . 0.0 112.972 -177.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -81.57 95.45 7.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.521 0.677 . . . . 0.0 110.058 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 35.8 t -94.42 120.82 35.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.038 -177.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.417 HD22 ' H ' ' A' ' 8' ' ' LEU . 2.9 mm? -68.39 -62.34 1.44 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.219 0.533 . . . . 0.0 110.436 -179.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -140.55 21.34 2.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.562 0.696 . . . . 0.0 109.628 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 115.15 -159.07 13.95 Favored Glycine 0 N--CA 1.441 -1.019 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 -170.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.6 m -95.32 100.48 11.09 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 121.648 0.737 . . . . 0.0 110.768 178.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.5 m -68.21 -20.26 64.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.178 177.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 148.87 174.6 20.63 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.724 177.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.417 ' HA ' ' HD2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -146.29 85.52 7.37 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 176.393 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.635 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 10.4 Cg_endo -53.45 139.75 64.89 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.315 2.677 . . . . 0.0 112.068 179.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.606 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 1.2 m-20 -63.8 -17.97 63.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.536 -178.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.4 t80 -59.83 -52.8 63.89 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.36 173.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.635 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -71.13 -33.24 69.91 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 -179.339 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.606 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 45.1 mtpt -58.71 -44.23 90.31 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.218 176.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.448 ' O ' ' HG2' ' A' ' 24' ' ' MET . 18.0 tpp85 -69.45 -51.36 36.91 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.704 177.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.7 tp -58.07 -49.86 75.47 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.848 -0.615 . . . . 0.0 112.467 -175.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -76.94 -27.3 54.78 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -177.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 8.7 tt0 -63.12 -55.57 24.21 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 120.923 0.392 . . . . 0.0 110.077 175.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.632 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.9 ptm -61.84 -34.02 75.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.158 177.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.427 ' HE3' ' HB2' ' A' ' 25' ' ' LYS . 3.7 tppp? -55.29 -55.62 29.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.101 174.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.564 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 39.4 tt0 -62.68 -40.39 96.96 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.651 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.459 ' HE2' ' HB3' ' A' ' 27' ' ' LYS . 5.2 mmmm -52.39 -39.82 61.32 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.467 177.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.724 HG12 HG11 ' A' ' 34' ' ' VAL . 68.0 t -70.27 -39.01 76.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.11 -178.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 65.7 mtt -73.9 -4.81 37.32 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.532 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 27.3 mmtp -98.81 -5.82 30.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.738 0.304 . . . . 0.0 111.506 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -84.81 141.34 30.55 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.111 0.481 . . . . 0.0 111.201 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -69.94 -39.93 75.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.899 -176.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -77.49 -42.15 36.76 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.902 0.382 . . . . 0.0 109.997 -174.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.724 HG11 HG12 ' A' ' 28' ' ' VAL . 40.0 t -54.57 -55.49 14.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.214 177.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.44 -32.56 74.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.755 0.312 . . . . 0.0 111.217 -177.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.69 -40.12 92.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.003 174.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -65.77 -40.45 92.03 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.608 176.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.82 HD11 HD11 ' A' ' 50' ' ' ILE . 2.0 mm? -57.54 -45.61 84.89 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.468 178.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -79.77 -20.46 46.22 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.926 0.394 . . . . 0.0 110.804 -178.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -68.4 -52.33 34.14 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.551 0.691 . . . . 0.0 109.966 176.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -106.86 29.97 6.55 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.131 -0.94 . . . . 0.0 111.329 -177.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -64.68 -16.08 62.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.283 0.563 . . . . 0.0 110.676 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.12 -19.89 59.69 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.579 178.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 39.8 t -119.37 -37.37 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.542 -173.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 68.8 mt -73.52 140.14 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.322 0.582 . . . . 0.0 111.919 -174.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -108.79 165.28 11.67 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.21 176.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -67.89 -36.99 81.2 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 172.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -57.69 -43.66 85.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.227 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 46.6 ttm -59.78 -37.17 78.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.851 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.82 HD11 HD11 ' A' ' 38' ' ' LEU . 38.6 mm -63.25 -54.89 27.25 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.174 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 48.8 mm-40 -50.83 -46.93 60.2 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 122.978 0.511 . . . . 0.0 111.459 176.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.4 mttt -68.74 -38.94 80.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.991 -177.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.418 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 5.6 m -101.67 17.38 23.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.342 0.592 . . . . 0.0 110.337 -176.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.479 HD23 HG22 ' A' ' 50' ' ' ILE . 0.7 OUTLIER -65.36 -43.81 89.64 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.343 -174.658 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -57.54 -34.48 69.19 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.715 175.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.425 ' O ' HD11 ' A' ' 96' ' ' ILE . 66.5 mmtt -67.27 -53.65 28.01 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.903 0.382 . . . . 0.0 110.807 178.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.424 HD11 HG21 ' A' ' 94' ' ' ILE . 10.9 mp -62.72 -39.68 94.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.465 -177.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.429 ' O ' ' HG2' ' A' ' 62' ' ' GLU . 48.2 t80 -67.5 -41.24 84.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.986 0.422 . . . . 0.0 110.383 178.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 23.5 tt0 -62.54 -41.18 98.71 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.978 178.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -56.03 -52.81 62.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.832 178.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 37.6 pt -69.39 -29.86 43.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 N-CA-C 111.992 0.368 . . . . 0.0 111.992 -174.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 58' ' ' TYR . 60.9 mm-40 -79.17 -17.04 55.69 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.923 0.392 . . . . 0.0 110.927 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 22.7 mt-30 -82.42 -175.3 5.64 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.423 0.63 . . . . 0.0 111.904 178.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.1 p -74.42 114.7 13.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.016 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -73.78 -27.53 61.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.912 -176.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.482 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.0 t-20 -115.24 -170.64 1.8 Allowed 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.03 -170.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.453 ' SG ' ' HB3' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -134.23 143.69 47.97 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 175.735 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 11.9 t -71.93 -11.5 60.82 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.256 -169.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.453 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 34.4 t80 -63.51 -31.75 73.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.917 175.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.482 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 32.1 p -114.64 -20.17 10.8 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.582 -0.447 . . . . 0.0 112.072 -173.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.5 p -113.42 142.85 45.4 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 110.306 -0.257 . . . . 0.0 110.306 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -112.51 24.55 12.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.525 0.678 . . . . 0.0 110.028 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -73.14 139.81 46.65 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.963 175.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -62.59 -24.03 67.34 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.937 -178.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -102.31 -1.39 31.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.669 -174.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 17.5 p -93.26 19.8 7.74 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.68 -174.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -71.84 96.35 1.64 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.425 0.631 . . . . 0.0 110.189 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -87.14 141.95 28.27 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.335 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.479 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.3 pt? -61.59 -40.56 95.21 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.055 0.455 . . . . 0.0 110.031 178.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 24.3 mt -86.32 158.36 19.68 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 172.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -140.48 131.16 25.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.483 0.658 . . . . 0.0 110.742 -170.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 80.69 6.08 89.58 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.893 -177.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.436 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 77.2 m-85 -132.51 156.45 46.77 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 122.261 0.224 . . . . 0.0 110.533 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -126.95 150.6 72.29 Favored Pre-proline 0 N--CA 1.466 0.347 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 175.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.55 149.89 27.54 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 122.552 2.168 . . . . 0.0 112.408 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 42.1 pttt -147.34 160.1 42.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.118 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -87.2 138.54 31.4 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 175.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.538 HG11 ' OE1' ' A' ' 97' ' ' GLU . 18.1 m -133.5 150.39 32.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.554 178.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 p -102.46 120.7 52.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.47 0.652 . . . . 0.0 110.789 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -122.54 99.94 6.67 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.732 176.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.405 ' C ' ' HD2' ' A' ' 92' ' ' ARG . . . 67.66 -111.64 4.21 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.548 -176.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.429 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 6.3 mpt_? -114.4 15.82 17.89 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.187 0.518 . . . . 0.0 109.884 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 32.1 p -125.89 138.65 53.81 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.762 -178.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.424 HG21 HD11 ' A' ' 57' ' ' LEU . 67.4 mt -98.3 132.88 42.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 178.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -124.89 178.92 5.24 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 -176.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.425 HD11 ' O ' ' A' ' 56' ' ' LYS . 50.2 mt -124.51 108.78 21.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.866 0.365 . . . . 0.0 110.59 -176.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.538 ' OE1' HG11 ' A' ' 88' ' ' VAL . 51.5 mt-10 -106.87 -178.14 3.56 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.134 177.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.436 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 4.5 m-85 -123.72 132.84 53.91 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.739 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 54.6 p90 -110.01 154.5 23.09 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 175.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -72.77 136.95 45.56 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.29 0.566 . . . . 0.0 110.848 -175.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 49.2 t -59.29 126.1 80.92 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.051 178.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 9.4 Cg_endo -55.7 -24.0 43.75 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 122.795 2.33 . . . . 0.0 111.984 176.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.734 ' HA ' ' HG2' ' A' ' 106' ' ' LYS . 25.0 t -81.44 -14.27 12.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.176 179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -68.59 -15.68 63.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.535 -173.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 65.1 mtt180 -133.2 33.52 3.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.734 ' HG2' ' HA ' ' A' ' 103' ' ' VAL . 33.8 mmtp . . . . . 0 C--O 1.235 0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.4 175.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.483 1.199 0 CA-C-O 120.942 0.401 . . . . 0.0 110.95 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.448 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.6 OUTLIER -108.59 145.51 31.75 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.237 -179.526 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 2' ' ' GLU . 5.5 Cg_exo -78.93 87.57 1.54 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.871 2.381 . . . . 0.0 112.487 -178.1 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 68.7 mt -74.16 -44.06 50.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.221 0.534 . . . . 0.0 110.458 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 113.35 125.17 4.27 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.348 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.76 -9.72 11.21 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.167 0.508 . . . . 0.0 110.409 178.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -129.16 88.94 2.78 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.935 177.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.5 mp -90.4 -60.52 1.9 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.069 178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.7 pt20 -149.27 132.9 16.8 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.936 -0.575 . . . . 0.0 109.931 178.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -101.12 107.54 3.27 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.536 177.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 28.6 m -78.62 133.74 29.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.198 0.523 . . . . 0.0 111.311 -177.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.0 p -94.23 2.24 55.92 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.597 -0.728 . . . . 0.0 109.814 175.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.448 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . 130.23 -154.02 20.39 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.088 -178.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.448 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 1.7 mpp_? -142.41 80.12 14.96 Favored Pre-proline 0 C--N 1.324 -0.514 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 176.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.47 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 26.7 Cg_endo -63.86 107.37 0.75 Allowed 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.861 2.374 . . . . 0.0 112.089 176.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -69.46 -23.83 63.71 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.162 -176.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -65.58 -48.42 72.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.693 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.47 ' HG2' ' HG2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -69.42 -31.67 70.16 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -179.161 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 52.1 mtpt -60.43 -50.11 74.88 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.987 175.027 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -63.95 -45.96 86.82 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.247 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.7 tp -58.06 -50.14 74.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.664 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 43.5 mm-40 -75.71 -26.97 58.02 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.4 tp-100 -57.98 -57.06 14.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.108 0.48 . . . . 0.0 109.713 174.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.505 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.8 ptm -65.65 -36.08 82.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.522 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 4.9 tppp? -54.01 -52.54 60.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.564 175.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.461 ' HA ' ' HG2' ' A' ' 29' ' ' MET . 38.2 tt0 -66.8 -43.56 83.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.866 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.3 mtpt -56.09 -41.86 75.82 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.639 179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 24' ' ' MET . 73.7 t -64.44 -44.07 97.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.693 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.461 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 23.6 ptp -82.03 2.1 32.6 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.195 0.521 . . . . 0.0 110.765 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 13.9 tptt -94.74 -29.24 14.88 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.048 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -66.27 143.95 56.9 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.398 0.618 . . . . 0.0 111.538 -174.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -69.11 -47.14 65.93 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.444 -175.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -71.45 -42.8 67.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.798 -177.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.494 HG22 HD11 ' A' ' 87' ' ' LEU . 51.0 t -56.48 -54.6 26.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.758 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.4 HE21 ' HB3' ' A' ' 35' ' ' GLN . 2.5 pt20 -65.92 -30.71 71.33 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.383 -176.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.545 ' HA ' ' HE3' ' A' ' 39' ' ' LYS . . . -62.52 -44.31 96.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.127 174.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.443 ' CE2' HD11 ' A' ' 45' ' ' ILE . 60.1 t80 -64.13 -39.62 94.42 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.676 177.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.603 HD11 HD11 ' A' ' 50' ' ' ILE . 2.6 mm? -58.37 -51.78 68.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.636 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.545 ' HE3' ' HA ' ' A' ' 36' ' ' ALA . 23.4 pttp -67.42 -28.16 67.67 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.023 0.439 . . . . 0.0 110.764 -177.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.81 -28.29 62.48 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.735 178.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -122.92 26.81 7.98 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.707 -174.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -66.52 -15.99 63.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.204 0.526 . . . . 0.0 110.968 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -70.9 -34.83 71.94 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.187 176.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 19.2 t -102.63 -39.56 6.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.366 -172.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.443 HD11 ' CE2' ' A' ' 37' ' ' PHE . 63.9 mt -75.96 138.46 20.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.069 -175.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.466 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.3 OUTLIER -131.44 -177.72 4.53 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.905 -178.311 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -57.93 -41.47 82.8 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.758 0.313 . . . . 0.0 111.487 179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -71.05 -42.04 69.98 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.58 -177.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 45.9 tpp -56.26 -36.2 68.3 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.778 177.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.603 HD11 HD11 ' A' ' 38' ' ' LEU . 41.4 mm -63.94 -49.27 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.896 177.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -68.65 -37.85 79.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.853 -178.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -58.94 -48.47 81.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.158 0.504 . . . . 0.0 110.863 176.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.644 ' OG ' ' HB ' ' A' ' 94' ' ' ILE . 33.6 t -98.8 17.03 20.41 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.769 -173.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 41.4 tp -60.16 -38.15 82.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.794 0.33 . . . . 0.0 110.457 -178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -74.17 -35.7 64.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.204 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 32.6 mmtp -66.63 -47.01 73.93 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.856 0.36 . . . . 0.0 110.811 177.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 53' ' ' SER . 95.1 mt -66.2 -39.07 89.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.632 -178.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -71.61 -37.89 70.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.241 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.675 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 31.2 tt0 -64.29 -36.81 85.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.186 0.517 . . . . 0.0 109.806 177.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.524 ' CE1' ' HB2' ' A' ' 85' ' ' PRO . 79.8 t80 -56.46 -51.15 69.52 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.184 176.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 34.0 pt -74.9 -29.7 22.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -174.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.675 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 7.5 pt-20 -80.14 -13.07 59.55 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.167 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.532 ' HG3' ' O ' ' A' ' 59' ' ' GLU . 45.6 mt-30 -85.63 -177.58 6.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.022 0.439 . . . . 0.0 110.54 174.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.1 t -87.47 105.15 17.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.311 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -69.4 -26.34 64.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.418 . . . . 0.0 109.991 175.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -83.0 -178.27 7.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.881 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.3 p -147.41 154.7 41.18 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.509 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 3.0 p -55.24 -33.48 63.16 Favored 'General case' 0 C--N 1.317 -0.811 0 O-C-N 124.239 0.962 . . . . 0.0 112.334 -174.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -62.54 -9.89 10.2 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.722 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.2 p -140.17 -0.79 1.61 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -178.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.466 ' OG ' ' HA ' ' A' ' 68' ' ' SER . 27.0 p -105.79 107.23 18.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.385 0.612 . . . . 0.0 111.307 -176.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -86.28 67.87 10.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.745 1.26 . . . . 0.0 109.255 176.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -153.79 156.97 38.69 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 113.006 -1.906 . . . . 0.0 108.435 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -63.64 -20.36 65.62 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 123.432 0.458 . . . . 0.0 111.563 -178.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -69.65 80.6 0.42 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.66 0.743 . . . . 0.0 111.2 177.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.509 ' SG ' ' HB3' ' A' ' 68' ' ' SER . 48.3 t -108.11 23.54 14.34 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.073 176.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -83.44 25.02 0.78 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.982 -174.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -80.14 139.35 36.86 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 174.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.431 ' HB3' HD12 ' A' ' 80' ' ' LEU . 3.0 tt -69.72 -65.19 0.75 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.961 0.41 . . . . 0.0 110.091 -177.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 79' ' ' LEU . 6.6 mp -85.64 122.14 29.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.94 0.4 . . . . 0.0 109.96 177.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -94.82 139.66 30.98 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.091 0.472 . . . . 0.0 110.196 178.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.35 -7.71 81.42 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.733 -178.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -121.27 164.2 17.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.456 0.169 . . . . 0.0 110.627 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.455 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 16.0 m170 -128.51 145.12 54.69 Favored Pre-proline 0 CA--C 1.515 -0.4 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.853 173.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.524 ' HB2' ' CE1' ' A' ' 60' ' ' TYR . 20.4 Cg_exo -64.0 135.55 48.23 Favored 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.516 2.144 . . . . 0.0 111.823 174.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.631 ' HG3' ' HB3' ' A' ' 97' ' ' GLU . 17.3 ptmt -134.21 146.74 50.4 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.536 -0.757 . . . . 0.0 109.175 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.494 HD11 HG22 ' A' ' 34' ' ' VAL . 98.1 mt -86.92 135.4 33.32 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 120.791 0.329 . . . . 0.0 110.705 -179.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 15.5 m -134.35 139.77 47.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.409 177.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.5 p -77.95 122.44 32.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 173.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -123.14 95.45 4.61 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.959 -171.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.449 ' C ' ' HD2' ' A' ' 92' ' ' ARG . . . 61.6 -106.97 1.31 Allowed Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.466 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.518 ' HD2' ' N ' ' A' ' 92' ' ' ARG . 2.4 mpt_? -111.86 19.63 17.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.03 0.443 . . . . 0.0 110.958 -178.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 13.3 t -145.41 178.68 7.93 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.644 ' HB ' ' OG ' ' A' ' 53' ' ' SER . 75.5 mt -116.33 137.33 50.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 174.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -130.51 177.07 7.64 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.156 0.503 . . . . 0.0 110.953 -173.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 61.7 mt -118.8 122.62 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.74 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.852 -176.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.631 ' HB3' ' HG3' ' A' ' 86' ' ' LYS . 14.4 tt0 -107.74 -176.76 3.15 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.316 -1.311 . . . . 0.0 108.425 178.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.455 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 9.6 m-85 -137.45 134.76 36.19 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 110.529 -0.174 . . . . 0.0 110.529 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.45 ' CD2' ' HB3' ' A' ' 86' ' ' LYS . 53.4 p90 -117.61 160.83 20.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.215 176.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -72.55 126.03 28.87 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.379 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.428 ' HA ' ' HD2' ' A' ' 102' ' ' PRO . 43.4 t -51.01 123.04 18.36 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.523 174.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 101' ' ' CYS . 9.2 Cg_endo -56.96 -18.7 29.12 Favored 'Trans proline' 0 CA--C 1.531 0.354 0 C-N-CA 123.306 2.671 . . . . 0.0 113.15 178.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.3 t -74.83 -13.01 15.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.148 0.499 . . . . 0.0 110.769 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.476 ' O ' ' HG2' ' A' ' 105' ' ' ARG . 53.3 mmtt -56.89 -51.21 69.98 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.819 173.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.476 ' HG2' ' O ' ' A' ' 104' ' ' LYS . 12.8 ptm180 45.86 28.72 0.62 Allowed 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.427 1.079 . . . . 0.0 112.814 177.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 104' ' ' LYS . 56.1 mttp . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.221 -178.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.9 ptm . . . . . 0 N--CA 1.483 1.189 0 CA-C-O 120.766 0.317 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 -112.86 87.49 10.26 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.94 -176.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -67.38 116.23 4.1 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 122.032 1.821 . . . . 0.0 111.52 177.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.426 ' O ' ' HD3' ' A' ' 6' ' ' ARG . 45.1 mm -67.81 -36.25 75.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.325 0.583 . . . . 0.0 110.123 -178.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.93 -65.01 4.19 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.434 175.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.62 ' HD3' ' H ' ' A' ' 6' ' ' ARG . 0.0 OUTLIER -88.91 79.29 7.37 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.803 0.811 . . . . 0.0 111.123 -177.001 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.7 m -76.12 92.89 3.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.581 174.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.4 mt -79.64 79.96 6.08 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.285 -0.871 . . . . 0.0 111.803 -174.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -77.11 91.16 3.67 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 165.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 101.47 84.5 1.81 Allowed Glycine 0 N--CA 1.446 -0.639 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -168.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 27.3 m -78.93 0.68 2.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -171.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.0 p -73.84 -10.77 60.0 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.794 -178.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.474 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -137.46 148.44 19.82 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.279 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.474 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.3 OUTLIER -143.26 83.01 11.3 Favored Pre-proline 0 C--N 1.329 -0.289 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.296 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.556 ' HB2' ' HG2' ' A' ' 18' ' ' GLN . 23.6 Cg_endo -62.73 91.39 0.13 Allowed 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.953 2.436 . . . . 0.0 112.919 177.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.533 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 30.9 t70 -77.27 -28.18 53.37 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.051 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.13 -49.83 72.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.909 178.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.556 ' HG2' ' HB2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -67.92 -30.42 69.74 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 121.166 -0.214 . . . . 0.0 110.587 -178.844 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.533 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 48.8 mtmt -63.51 -50.11 70.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.96 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.404 ' HE ' ' HB2' ' A' ' 20' ' ' ARG . 11.5 ptm180 -72.54 -28.05 62.6 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.769 -179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 35.3 tp -67.62 -49.98 60.34 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.858 0.361 . . . . 0.0 110.802 178.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -64.93 -32.66 74.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.419 176.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -62.33 -57.38 11.55 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.409 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.45 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.7 ptm -63.51 -39.04 93.38 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.792 -179.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.58 ' O ' ' HG2' ' A' ' 29' ' ' MET . 19.3 tptp -60.22 -48.85 79.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.457 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.405 ' O ' ' HB3' ' A' ' 30' ' ' LYS . 5.7 tp10 -54.08 -50.35 66.99 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.316 176.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.62 ' HA ' ' HE3' ' A' ' 30' ' ' LYS . 62.8 mtpt -54.86 -48.35 73.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.615 -176.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.563 ' HA ' HD13 ' A' ' 61' ' ' ILE . 91.3 t -64.63 -46.18 93.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.078 0.466 . . . . 0.0 111.112 -176.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.58 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 25.2 ptt? -88.08 5.99 38.43 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.442 0.639 . . . . 0.0 110.463 -171.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.653 ' HD2' ' N ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -102.81 -34.71 8.9 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.087 -0.961 . . . . 0.0 109.875 175.159 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.653 ' N ' ' HD2' ' A' ' 30' ' ' LYS . 0.1 OUTLIER -59.42 132.02 52.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.508 -0.769 . . . . 0.0 111.314 -172.523 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -62.9 -41.93 99.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.939 -172.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -60.1 -39.08 84.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.421 0.629 . . . . 0.0 110.207 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 97.5 t -65.27 -37.93 81.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.663 -179.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 70.9 mm-40 -58.76 -54.09 51.05 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.183 0.516 . . . . 0.0 110.766 178.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.24 -35.11 76.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.24 -176.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.506 ' CZ ' HG23 ' A' ' 89' ' ' VAL . 82.0 t80 -71.35 -42.4 68.56 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.714 178.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.757 HD11 HD11 ' A' ' 50' ' ' ILE . 1.1 mm? -59.31 -43.35 92.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.585 -179.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -79.14 -25.33 42.9 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.607 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -65.41 -54.75 24.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.304 0.573 . . . . 0.0 110.402 177.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -103.01 30.0 5.1 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.359 -174.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -60.46 -32.47 71.42 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -175.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -69.88 -28.99 66.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.238 0.542 . . . . 0.0 110.478 -177.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 17.2 t -97.54 -43.86 12.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.605 -176.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.729 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 66.2 mt -72.36 142.56 15.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.534 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -120.5 164.35 16.56 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.853 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -54.56 -45.0 73.4 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.305 0.574 . . . . 0.0 110.558 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -66.99 -35.83 80.83 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.616 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.729 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 23.0 ttt -59.91 -36.59 77.3 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.402 177.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.757 HD11 HD11 ' A' ' 38' ' ' LEU . 44.0 mm -62.74 -50.94 77.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.537 177.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.84 -39.31 93.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.634 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -60.95 -42.81 98.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.175 -179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.448 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.7 m -107.62 22.98 15.16 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.976 -175.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 25.6 tp -64.9 -26.33 68.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.01 0.433 . . . . 0.0 109.872 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -67.86 -41.23 83.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.166 176.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -67.71 -50.59 56.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.257 176.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 53' ' ' SER . 83.1 mt -58.19 -40.19 80.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.022 -179.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -71.9 -45.88 59.67 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.29 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.553 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 40.7 tt0 -62.4 -34.79 77.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.369 0.604 . . . . 0.0 110.163 178.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -56.99 -53.27 59.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.295 176.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.563 HD13 ' HA ' ' A' ' 28' ' ' VAL . 41.9 pt -73.81 -30.6 28.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -174.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.553 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 8.7 pt-20 -78.74 -19.75 51.58 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 120.939 -0.305 . . . . 0.0 111.53 -177.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 42.9 mt-30 -73.2 -177.93 2.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.118 0.485 . . . . 0.0 110.964 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.583 ' HB2' ' HB2' ' A' ' 77' ' ' ASN . 13.7 t -71.42 114.17 9.21 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.217 -177.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -64.59 -44.66 89.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.004 -179.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.425 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 2.3 m-20 -98.47 -163.45 1.04 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.916 177.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.4 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 4.9 p -148.58 157.09 43.22 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 179.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.449 ' OG ' ' HB3' ' A' ' 76' ' ' CYS . 2.6 m -62.23 -24.04 67.01 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.324 0.583 . . . . 0.0 111.188 -171.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -62.43 -20.06 64.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.255 177.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.3 p -128.07 -25.54 3.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.292 0.479 . . . . 0.0 112.292 -176.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.1 p -106.12 -171.91 1.99 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.732 0.301 . . . . 0.0 111.47 -175.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -107.63 17.36 22.73 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.432 -175.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -69.02 121.46 16.71 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.39 -40.15 27.04 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.043 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -101.97 85.18 2.64 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.102 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.449 ' HB3' ' OG ' ' A' ' 68' ' ' SER . 19.0 p -47.93 114.35 0.9 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.057 -0.974 . . . . 0.0 111.588 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . 0.583 ' HB2' ' HB2' ' A' ' 64' ' ' SER . 75.2 m-20 -87.35 -6.79 58.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.936 175.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.4 ' OD1' ' HA ' ' A' ' 67' ' ' CYS . 12.9 m120 -82.06 116.55 21.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.604 176.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.5 tp -61.09 -55.19 35.5 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 175.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.5 mp -86.93 87.72 7.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.566 172.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -72.06 148.97 45.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.023 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.54 -9.06 75.07 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 -171.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.437 ' CB ' ' HD2' ' A' ' 98' ' ' TYR . 74.9 m-85 -123.13 168.05 12.89 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.425 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 17.5 m170 -127.95 150.97 75.02 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 172.062 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.401 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 57.4 Cg_endo -74.35 142.5 30.15 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 122.09 1.86 . . . . 0.0 111.391 174.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.515 ' HB3' ' CE1' ' A' ' 99' ' ' TYR . 25.2 pttm -140.31 153.46 46.46 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.9 mt -84.92 142.82 29.4 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.624 -179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.1 m -136.2 148.63 27.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.077 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.529 HG22 ' HE1' ' A' ' 49' ' ' MET . 4.5 t -103.64 114.12 42.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.355 0.598 . . . . 0.0 110.263 176.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -114.43 96.17 5.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.647 -179.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.82 -112.28 3.88 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.837 -0.697 . . . . 0.0 111.585 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -117.46 16.09 14.69 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.143 0.497 . . . . 0.0 110.278 176.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 15.3 m -124.18 136.95 54.55 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.147 177.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.455 HG12 HG22 ' A' ' 89' ' ' VAL . 58.2 mt -94.51 135.18 29.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -128.56 178.61 6.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.077 0.465 . . . . 0.0 110.799 -173.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 69.3 mt -118.94 130.26 74.01 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.291 -176.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.401 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 0.0 OUTLIER -126.06 176.38 7.06 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.352 -177.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.437 ' HD2' ' CB ' ' A' ' 83' ' ' TYR . 5.0 m-85 -128.71 149.94 50.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.767 0.318 . . . . 0.0 110.736 176.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.515 ' CE1' ' HB3' ' A' ' 86' ' ' LYS . 51.3 p90 -139.95 152.54 46.42 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 176.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.426 ' HG3' ' CE2' ' A' ' 83' ' ' TYR . 2.5 mp0 -61.27 134.2 56.71 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.982 0.42 . . . . 0.0 111.236 -178.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 42.6 t -53.38 123.21 35.02 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.448 175.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.77 -25.52 79.48 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.829 2.352 . . . . 0.0 112.176 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 50.8 t -67.81 -19.95 25.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.871 179.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -76.77 -18.12 58.64 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.391 0.615 . . . . 0.0 109.882 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -103.35 97.57 7.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.866 -179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 66.3 mttm . . . . . 0 C--N 1.322 -0.6 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.809 -177.53 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 120.998 0.428 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.445 ' HA ' ' HD2' ' A' ' 3' ' ' PRO . 44.7 mt-10 -115.24 88.22 17.79 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.945 174.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.445 ' HD2' ' HA ' ' A' ' 2' ' ' GLU . 6.6 Cg_endo -47.77 115.79 1.61 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.267 2.644 . . . . 0.0 112.264 -177.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.3 mm -88.23 103.92 14.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.199 0.523 . . . . 0.0 111.182 -177.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -143.76 -168.79 12.43 Favored Glycine 0 N--CA 1.447 -0.612 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 176.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -151.08 135.73 17.15 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 117.857 0.829 . . . . 0.0 111.146 177.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 19.8 m -79.82 101.63 8.62 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.573 175.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 89.3 mt -44.11 -62.56 1.1 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.936 0.773 . . . . 0.0 112.778 -173.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -104.31 -3.79 23.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.911 0.386 . . . . 0.0 111.323 -177.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -101.59 56.71 0.69 Allowed Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.552 -176.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.8 t -101.13 -47.66 11.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.04 0.448 . . . . 0.0 110.45 178.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.0 t -60.59 -27.51 67.78 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.484 -178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.419 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -159.74 151.39 22.12 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.986 -0.626 . . . . 0.0 111.671 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.419 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.5 OUTLIER -143.2 73.83 17.77 Favored Pre-proline 0 C--N 1.328 -0.333 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.613 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -77.54 161.3 31.3 Favored 'Trans proline' 0 N--CA 1.464 -0.234 0 C-N-CA 122.712 2.275 . . . . 0.0 112.039 176.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.618 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 2.4 p-10 -68.38 -27.25 66.07 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 177.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -49.6 -49.58 46.2 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.457 -178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.09 -33.26 75.37 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.681 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 26.0 mmtp -73.55 -29.44 62.44 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -179.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.618 ' HG2' ' O ' ' A' ' 16' ' ' ASP . 13.7 mmm-85 -68.37 -46.47 69.99 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 172.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.7 tp -55.57 -48.88 74.07 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.116 177.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -65.56 -39.14 91.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.017 177.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.52 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 5.9 tp-100 -63.76 -52.1 61.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.764 -177.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.518 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.8 ptm -66.63 -38.28 86.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.48 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 49.1 tptt -59.46 -44.22 93.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.178 0.513 . . . . 0.0 109.931 177.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.466 ' HA ' ' HG2' ' A' ' 29' ' ' MET . 33.1 tt0 -67.07 -44.41 80.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.318 179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -52.29 -51.01 61.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.215 177.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 24' ' ' MET . 85.5 t -59.06 -41.82 84.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.944 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.466 ' HG2' ' HA ' ' A' ' 26' ' ' GLU . 21.7 ptp -85.52 14.91 4.99 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -176.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.414 ' HD3' ' HG2' ' A' ' 26' ' ' GLU . 3.6 mptp? -119.45 -2.33 10.58 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 176.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.681 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 29.6 t70 -85.3 135.11 34.05 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.777 -0.369 . . . . 0.0 110.617 179.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.52 ' HG3' ' N ' ' A' ' 33' ' ' ASP . 5.1 pt20 -63.34 -41.16 98.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.073 -176.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.52 ' N ' ' HG3' ' A' ' 32' ' ' GLN . 11.9 m-20 -74.12 -33.1 63.46 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.022 0.439 . . . . 0.0 110.001 -175.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.13 -43.9 93.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.047 172.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.681 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 71.2 mm-40 -56.44 -50.32 72.02 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.269 0.557 . . . . 0.0 110.496 177.614 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -56.9 -45.66 82.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.141 -0.936 . . . . 0.0 111.424 -178.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -67.34 -41.35 85.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.136 179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.456 HD11 HD11 ' A' ' 50' ' ' ILE . 1.9 mm? -57.82 -43.83 86.02 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.449 -178.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.544 ' HA ' ' HB3' ' A' ' 42' ' ' GLU . 2.6 ptmm? -82.8 -22.04 34.33 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.753 -179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 1.1 tm-20 -65.92 -39.56 90.66 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -116.81 32.48 6.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.843 -179.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.544 ' HB3' ' HA ' ' A' ' 39' ' ' LYS . 10.7 pt-20 -61.43 -22.5 65.08 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.073 0.463 . . . . 0.0 111.181 -178.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -77.62 -34.63 53.29 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.838 177.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 11.3 t -93.29 -39.36 10.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.394 -171.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.532 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 76.1 mt -71.61 142.97 14.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 121.24 0.543 . . . . 0.0 111.434 -174.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -120.81 166.02 14.34 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.031 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 57.4 mt-30 -57.69 -44.17 85.63 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.241 0.543 . . . . 0.0 109.963 174.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 91.8 mttt -63.71 -38.33 90.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.029 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.532 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 50.7 ttm -57.01 -39.16 74.19 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.255 177.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.456 HD11 HD11 ' A' ' 38' ' ' LEU . 45.7 mm -67.27 -42.06 87.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.879 178.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 42.7 mm-40 -66.88 -43.28 83.91 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.129 0.49 . . . . 0.0 110.417 -178.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -67.57 -30.24 69.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.3 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.501 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.5 m -109.0 19.1 19.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.262 -175.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 mt -59.76 -46.6 88.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.053 0.454 . . . . 0.0 110.427 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -57.73 -39.84 78.24 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.856 176.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.576 ' O ' HD11 ' A' ' 96' ' ' ILE . 4.9 mmpt? -67.66 -51.05 54.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.139 0.495 . . . . 0.0 110.283 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 53' ' ' SER . 90.3 mt -62.24 -41.65 98.61 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.127 -177.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -69.49 -43.97 72.08 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.414 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.574 ' HG3' ' NE2' ' A' ' 63' ' ' GLN . 11.1 tp10 -56.44 -39.38 73.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.135 0.493 . . . . 0.0 109.892 175.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.442 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 56.2 t80 -56.52 -52.61 64.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.917 179.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.54 ' HA ' ' HD3' ' A' ' 65' ' ' LYS . 32.9 pt -75.53 -30.57 22.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -174.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -77.61 -19.62 55.25 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 111.283 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.574 ' NE2' ' HG3' ' A' ' 59' ' ' GLU . 46.0 mt-30 -78.79 -171.54 2.61 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.163 0.506 . . . . 0.0 110.756 175.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 33.2 p -75.64 99.74 4.41 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.423 178.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.54 ' HD3' ' HA ' ' A' ' 61' ' ' ILE . 12.3 mmmm -63.78 -26.49 68.66 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.206 0.527 . . . . 0.0 110.265 176.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.539 ' OD1' ' SG ' ' A' ' 70' ' ' CYS . 9.5 t-20 -112.63 -165.65 1.01 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.568 -178.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -148.09 154.53 40.33 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.5 -0.48 . . . . 0.0 110.902 178.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.657 ' HA ' ' O ' ' A' ' 71' ' ' SER . 25.6 t -67.78 -20.62 65.22 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.236 -175.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.416 ' HB2' ' HA2' ' A' ' 82' ' ' GLY . 8.2 t80 -69.44 -13.67 62.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 111.601 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.539 ' SG ' ' OD1' ' A' ' 66' ' ' ASN . 24.6 p -123.33 -33.69 3.22 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.696 -0.401 . . . . 0.0 110.534 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.657 ' O ' ' HA ' ' A' ' 68' ' ' SER . 39.5 m -125.29 103.79 8.13 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -85.66 61.24 6.73 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.904 0.859 . . . . 0.0 110.614 -173.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -85.37 139.42 31.58 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.629 -1.169 . . . . 0.0 109.511 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -86.54 -21.76 26.73 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.656 -174.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -90.28 -34.02 15.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.694 0.283 . . . . 0.0 111.228 -174.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 84.6 m -62.67 120.41 11.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.109 0.481 . . . . 0.0 111.496 -178.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 42.0 t30 -77.64 92.89 4.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.551 ' OD1' ' HA ' ' A' ' 81' ' ' GLU . 2.4 t-20 -100.43 117.9 35.55 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.715 178.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 74.1 mt -74.06 -74.46 0.19 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.466 -176.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.0 mp -85.57 96.78 9.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 174.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.619 ' HG3' ' HB3' ' A' ' 68' ' ' SER . 30.7 tt0 -72.62 124.71 25.82 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.176 0.512 . . . . 0.0 110.173 -177.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.416 ' HA2' ' HB2' ' A' ' 69' ' ' TYR . . . 103.88 -7.74 49.45 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.333 -176.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.576 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 15.5 m-85 -121.37 162.01 21.12 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 178.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.0 m170 -124.68 150.88 66.69 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 173.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.435 ' HB2' ' CD1' ' A' ' 60' ' ' TYR . 55.5 Cg_endo -71.39 141.44 38.81 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 122.672 2.248 . . . . 0.0 111.536 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.611 ' HB2' ' CD1' ' A' ' 99' ' ' TYR . 86.4 tttt -131.47 131.14 43.27 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.568 -172.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.476 HD12 ' HA ' ' A' ' 87' ' ' LEU . 0.4 OUTLIER -85.76 125.98 33.65 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.254 177.429 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.619 HG11 ' HG3' ' A' ' 97' ' ' GLU . 29.5 m -131.26 145.21 35.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 120.668 0.271 . . . . 0.0 110.882 178.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.4 p -95.52 120.42 44.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.259 0.552 . . . . 0.0 110.024 176.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -121.96 96.3 5.0 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.866 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 73.65 -104.31 1.59 Allowed Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.151 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -116.57 5.71 13.34 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.565 0.221 . . . . 0.0 111.175 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 2.1 p -130.01 159.86 35.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.975 0.417 . . . . 0.0 111.35 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 67.9 mt -110.28 137.9 40.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.92 -177.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.508 ' HA ' ' HD3' ' A' ' 56' ' ' LYS . 1.8 t0 -126.97 178.92 5.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.879 0.371 . . . . 0.0 110.63 -175.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.576 HD11 ' O ' ' A' ' 56' ' ' LYS . 44.8 mt -123.1 112.61 34.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.195 -176.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.619 ' HG3' HG11 ' A' ' 88' ' ' VAL . 3.7 mm-40 -98.61 -175.11 2.98 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.272 174.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.576 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 3.3 m-85 -139.67 124.03 18.06 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 110.04 -0.356 . . . . 0.0 110.04 174.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.611 ' CD1' ' HB2' ' A' ' 86' ' ' LYS . 39.0 p90 -110.41 147.02 34.85 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 176.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.538 ' H ' ' CD ' ' A' ' 100' ' ' GLU . 2.3 pm0 -66.44 135.06 53.73 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.478 0.656 . . . . 0.0 110.713 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.457 ' SG ' HG12 ' A' ' 103' ' ' VAL . 21.3 t -44.52 124.67 4.75 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 114.195 -1.366 . . . . 0.0 111.857 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -59.32 -10.23 10.34 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 123.339 2.693 . . . . 0.0 113.435 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.457 HG12 ' SG ' ' A' ' 101' ' ' CYS . 8.7 p -66.57 -18.33 23.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-O 121.035 0.445 . . . . 0.0 110.625 178.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.412 ' HD2' ' HA ' ' A' ' 104' ' ' LYS . 13.1 mmmm -78.16 -24.19 47.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.894 176.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -133.97 75.96 1.63 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.311 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.257 178.279 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.0 ttm . . . . . 0 N--CA 1.48 1.053 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.476 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 2.7 mp0 -62.71 145.09 95.95 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.856 -177.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 2' ' ' GLU . 14.5 Cg_exo -68.32 95.04 0.43 Allowed 'Trans proline' 0 N--CA 1.463 -0.312 0 C-N-CA 122.894 2.396 . . . . 0.0 112.874 -177.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.8 tp -116.94 112.5 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.749 172.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -95.21 -50.21 2.09 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.407 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -81.67 89.19 6.23 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.076 0.465 . . . . 0.0 110.804 -178.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 34.5 p -103.43 169.28 8.63 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.834 177.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 89.3 mt -106.31 7.63 31.39 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.994 0.426 . . . . 0.0 110.815 -176.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -91.42 23.26 3.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.068 -179.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -133.92 79.72 0.33 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.65 -0.786 . . . . 0.0 111.966 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 63.4 t -62.72 110.12 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.944 0.402 . . . . 0.0 110.47 -179.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.4 p -140.61 176.35 8.85 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.017 -177.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.451 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -77.52 176.04 53.84 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.975 174.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.451 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.2 OUTLIER -141.38 84.11 12.89 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-O 120.9 0.381 . . . . 0.0 110.434 -177.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.411 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 22.1 Cg_endo -62.73 124.27 13.81 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.553 2.168 . . . . 0.0 111.62 173.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.426 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 11.4 m-20 -61.51 -29.59 70.09 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.263 -176.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -56.81 -51.71 67.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.142 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.42 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -70.66 -31.18 68.01 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.313 -177.79 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.462 ' HE3' ' HB3' ' A' ' 19' ' ' LYS . 21.1 mtpp -66.59 -48.77 68.49 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.966 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.506 ' O ' ' HG2' ' A' ' 24' ' ' MET . 7.2 ptm180 -68.47 -31.69 71.16 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 37.2 tp -62.86 -50.28 71.53 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -59.66 -45.13 92.95 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 120.952 0.406 . . . . 0.0 110.31 176.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -59.1 -57.76 11.62 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.385 -175.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.506 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 25.3 ptm -66.74 -38.3 86.39 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.39 -177.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.448 ' HA ' ' HD2' ' A' ' 25' ' ' LYS . 17.0 tptm -64.81 -41.46 95.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.004 0.431 . . . . 0.0 110.292 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.526 ' HG3' ' HD3' ' A' ' 30' ' ' LYS . 23.4 tt0 -61.83 -50.63 71.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.557 177.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -54.41 -42.27 70.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.303 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.487 HG23 ' O ' ' A' ' 24' ' ' MET . 87.0 t -68.87 -42.75 82.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.968 0.413 . . . . 0.0 110.953 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 44.4 mtt -78.69 -6.93 57.09 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -175.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.526 ' HD3' ' HG3' ' A' ' 26' ' ' GLU . 2.1 mptm? -103.26 -4.08 24.78 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -178.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.703 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 25.2 t70 -83.41 134.0 34.9 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.683 -0.407 . . . . 0.0 110.843 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -66.25 -41.34 90.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.851 -175.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -74.32 -35.49 63.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.776 0.322 . . . . 0.0 110.393 -174.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.8 t -55.67 -47.65 78.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.774 172.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.703 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 35.1 mt-30 -65.02 -31.75 73.13 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.155 0.502 . . . . 0.0 110.88 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.34 -46.49 88.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.464 176.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -65.52 -42.35 92.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.407 176.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.434 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.8 mm? -57.36 -44.43 84.35 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.703 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -73.75 -28.18 61.55 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.923 -177.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -66.47 -55.71 14.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.619 0.723 . . . . 0.0 110.474 178.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 37.9 m-80 -102.47 30.23 4.74 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.627 -174.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -60.4 -27.41 67.43 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 112.124 -177.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -85.79 -24.1 26.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.885 0.374 . . . . 0.0 111.122 -179.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 22.0 t -93.4 -35.15 6.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 121.277 0.56 . . . . 0.0 111.147 -172.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.48 HG23 ' HE2' ' A' ' 49' ' ' MET . 50.7 mt -88.27 150.99 3.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.522 -178.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -119.34 163.2 17.53 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.443 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 29.9 mm-40 -59.61 -39.06 82.98 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.606 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -64.52 -38.05 89.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.045 0.45 . . . . 0.0 110.554 178.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.48 ' HE2' HG23 ' A' ' 45' ' ' ILE . 2.1 ttp -67.43 -31.93 72.45 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.224 178.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.0 mm -63.69 -46.39 94.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.256 175.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 9.7 mm-40 -67.37 -40.46 85.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.74 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.2 tptp -66.68 -43.52 84.23 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.02 -179.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.401 ' HB2' HD12 ' A' ' 94' ' ' ILE . 50.6 m -98.98 19.31 15.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.002 -178.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 42.8 tp -63.06 -30.12 71.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -61.83 -38.08 86.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.02 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 17.1 mmtm -74.95 -40.64 60.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.321 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -62.09 -41.06 97.8 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.331 0.586 . . . . 0.0 110.167 175.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 12.3 t80 -69.62 -44.47 70.62 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.539 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.56 ' HG2' ' NE2' ' A' ' 63' ' ' GLN . 45.3 tt0 -64.13 -35.4 80.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.344 178.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.541 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 26.3 t80 -56.15 -56.1 25.04 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.369 177.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 22.1 pt -69.31 -30.99 47.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.09 -174.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.487 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 11.0 pt-20 -80.53 -24.97 38.95 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.142 -0.623 . . . . 0.0 112.241 -174.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.56 ' NE2' ' HG2' ' A' ' 59' ' ' GLU . 49.7 mt-30 -77.76 -32.4 52.6 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.833 -176.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.455 ' OG ' ' HB2' ' A' ' 78' ' ' ASN . 10.9 m -178.84 118.37 0.07 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.047 -175.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.71 -51.79 6.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.8 0.81 . . . . 0.0 109.088 169.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.533 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 30.7 p30 -115.71 -157.81 0.66 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.948 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.482 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 8.2 p -152.62 163.55 39.41 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 44.4 t -54.92 -31.13 59.94 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 123.829 0.706 . . . . 0.0 111.286 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.458 ' HB2' ' HA2' ' A' ' 82' ' ' GLY . 0.1 OUTLIER -75.36 4.97 6.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.286 -0.416 . . . . 0.0 112.036 -178.656 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 66' ' ' ASN . 31.9 p -151.64 19.25 0.71 Allowed 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.141 0.496 . . . . 0.0 110.352 175.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 30.6 t -129.65 153.38 48.17 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.414 -178.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 25.5 tp10 -77.44 -27.1 52.05 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -84.6 129.25 34.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.349 179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -128.96 -4.86 5.06 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.564 174.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -75.51 -40.56 56.93 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.209 -175.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 26.4 p -152.07 26.18 0.62 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.866 0.365 . . . . 0.0 110.934 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -68.89 -60.44 2.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.253 -173.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.482 ' OD1' ' HA ' ' A' ' 67' ' ' CYS . 1.3 p-10 -160.97 156.98 25.61 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.28 -0.418 . . . . 0.0 109.928 -177.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -74.06 -56.81 4.48 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.789 0.328 . . . . 0.0 111.161 -174.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 29.1 mt -82.29 81.25 8.24 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.43 0.633 . . . . 0.0 111.058 -176.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -64.59 129.34 39.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.767 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.458 ' HA2' ' HB2' ' A' ' 69' ' ' TYR . . . 97.52 -9.02 64.47 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.346 178.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.73 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 44.7 m-85 -125.0 157.93 34.94 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 111.394 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.533 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 12.5 m170 -129.61 155.29 80.51 Favored Pre-proline 0 CA--C 1.51 -0.59 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 171.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.541 ' O ' ' HE1' ' A' ' 60' ' ' TYR . 38.2 Cg_endo -77.81 151.61 28.17 Favored 'Trans proline' 0 N--CA 1.446 -1.318 0 C-N-CA 122.096 1.864 . . . . 0.0 110.717 172.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 31.5 ttpt -144.83 141.35 29.07 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 176.274 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.466 HD22 ' H ' ' A' ' 87' ' ' LEU . 1.8 mm? -78.7 140.01 38.4 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 32.2 m -132.26 147.84 32.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 175.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.4 p -98.17 114.4 35.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.406 0.622 . . . . 0.0 110.298 178.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -117.42 96.32 5.35 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.556 178.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 68.83 -107.38 2.07 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.066 -178.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -116.96 19.16 14.46 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.218 0.533 . . . . 0.0 110.482 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 9.8 p -135.42 141.77 45.5 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.234 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.401 HD12 ' HB2' ' A' ' 53' ' ' SER . 68.1 mt -96.54 131.84 42.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.116 178.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -120.48 178.13 4.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.636 -175.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 70.8 mt -132.93 114.53 22.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 120.851 0.357 . . . . 0.0 110.934 -176.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 9.4 pt-20 -103.13 -177.05 3.26 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.73 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 2.9 m-85 -130.25 123.61 30.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.107 0.48 . . . . 0.0 110.587 175.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.467 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 51.2 p90 -112.75 151.88 29.77 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 176.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.412 ' HA ' ' HA ' ' A' ' 83' ' ' TYR . 5.4 pt-20 -84.42 133.26 34.51 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.744 0.783 . . . . 0.0 111.467 -178.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 104' ' ' LYS . 6.6 t -46.8 123.49 7.65 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.803 -178.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.93 -10.79 29.7 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.801 2.334 . . . . 0.0 112.442 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 59.6 t -69.0 -20.44 24.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.925 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 101' ' ' CYS . 22.3 ptmt -67.87 -23.65 65.16 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.683 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -105.13 119.56 39.33 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.206 0.527 . . . . 0.0 110.132 177.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.694 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.636 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.103 0 CA-C-O 121.064 0.459 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -72.85 147.41 88.8 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.633 -175.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.0 105.06 0.21 Allowed 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.728 2.285 . . . . 0.0 111.05 175.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 65.1 mt -60.1 122.7 11.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.339 -174.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -134.09 119.06 2.16 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 177.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.434 ' HG3' ' H ' ' A' ' 8' ' ' LEU . 15.9 tpt180 -89.39 134.41 34.09 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 110.181 -0.303 . . . . 0.0 110.181 -177.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.7 m -63.31 -21.56 66.33 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.3 -179.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.434 ' H ' ' HG3' ' A' ' 6' ' ' ARG . 41.0 mt -83.02 87.97 6.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.089 0.471 . . . . 0.0 111.31 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -83.84 -47.66 10.86 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 171.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -131.4 109.08 0.85 Allowed Glycine 0 N--CA 1.444 -0.789 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.562 175.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.452 HG12 ' HG3' ' A' ' 14' ' ' ARG . 17.3 t -75.2 98.64 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 120.817 0.341 . . . . 0.0 110.383 -177.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 t -82.93 -38.13 23.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.685 -177.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -104.75 131.12 10.5 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.508 -0.854 . . . . 0.0 111.487 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.452 ' HG3' HG12 ' A' ' 11' ' ' VAL . 0.1 OUTLIER -143.69 65.09 14.07 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.918 0.359 . . . . 0.0 110.675 -177.655 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.511 ' HB2' ' HG2' ' A' ' 18' ' ' GLN . 28.7 Cg_exo -62.02 105.61 0.4 Allowed 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.314 2.01 . . . . 0.0 111.524 173.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -55.71 -37.37 68.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.231 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -54.58 -56.16 21.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.685 -178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.531 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 2.9 pt20 -71.5 -30.29 65.79 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.733 -177.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 29.9 mtpp -59.01 -47.92 83.47 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.533 178.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.403 ' HD3' HH11 ' A' ' 20' ' ' ARG . 19.7 ptt180 -77.49 -29.98 52.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.694 178.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.531 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 23.5 tp -61.1 -50.02 74.92 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.899 179.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.422 ' HA ' ' HB3' ' A' ' 25' ' ' LYS . 21.8 mm-40 -75.68 -27.2 58.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.097 178.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 34.1 tt0 -62.25 -54.87 34.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.931 0.396 . . . . 0.0 110.551 178.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.499 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.3 ptm -65.67 -36.99 85.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.025 177.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.422 ' HB3' ' HA ' ' A' ' 22' ' ' GLU . 11.7 tptm -54.3 -49.33 69.91 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.695 175.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -60.14 -48.3 82.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.996 -175.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -57.34 -40.3 77.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 112.111 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 24' ' ' MET . 60.7 t -70.96 -33.89 53.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.168 0.509 . . . . 0.0 110.393 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.5 mmt -71.03 -14.01 62.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.125 -176.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.77 14.51 12.56 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.693 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 18.3 t70 -85.31 135.48 33.89 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.549 176.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -63.99 -47.31 80.84 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.83 -175.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -70.48 -34.04 71.92 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.893 0.377 . . . . 0.0 110.405 -175.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 76.4 t -58.59 -43.23 86.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.761 174.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.693 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 61.9 mm-40 -59.59 -49.06 79.22 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.171 0.51 . . . . 0.0 110.527 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -55.52 -43.48 75.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.609 -177.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.505 ' CE2' HD11 ' A' ' 45' ' ' ILE . 78.3 t80 -72.28 -40.98 67.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.057 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.92 HD11 HD11 ' A' ' 50' ' ' ILE . 1.9 mm? -60.11 -45.54 92.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.538 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -73.71 -26.15 60.56 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.536 -178.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -66.35 -54.92 18.97 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.384 0.612 . . . . 0.0 110.307 176.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -105.69 32.64 4.2 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.483 -173.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -62.43 -24.45 67.42 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.944 0.402 . . . . 0.0 111.178 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -68.5 -36.42 78.87 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.336 0.588 . . . . 0.0 110.011 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 15.4 t -93.9 -43.21 13.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.83 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.505 HD11 ' CE2' ' A' ' 37' ' ' PHE . 67.9 mt -75.63 144.21 12.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.864 -176.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -131.25 176.72 8.04 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 175.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.413 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 99.3 mt-30 -59.74 -39.93 86.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.763 0.316 . . . . 0.0 111.82 -177.446 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -72.8 -36.8 67.66 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.935 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.484 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 53.6 ttm -56.47 -36.58 69.25 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 174.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.92 HD11 HD11 ' A' ' 38' ' ' LEU . 37.2 mm -61.48 -54.71 31.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.996 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.734 ' HA ' HD23 ' A' ' 54' ' ' LEU . 29.7 mt-10 -68.82 -34.6 75.78 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.581 0.215 . . . . 0.0 111.581 -178.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.4 tptp -65.02 -26.54 68.32 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.906 0.384 . . . . 0.0 110.525 177.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -115.2 16.36 16.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.38 -178.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.734 HD23 ' HA ' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -58.83 -41.16 86.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.613 -178.685 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -55.48 -43.77 75.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.436 176.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.505 ' O ' HD11 ' A' ' 96' ' ' ILE . 33.2 mmtp -71.49 -48.38 49.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.861 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 91.5 mt -58.57 -42.26 87.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.034 0.445 . . . . 0.0 110.753 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -70.08 -39.44 75.59 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.423 -179.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -61.01 -40.13 92.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.038 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.457 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 70.0 t80 -63.25 -50.49 69.99 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.979 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 30.1 pt -70.28 -31.27 46.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -171.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -85.38 -25.67 26.92 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.335 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.457 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 0.8 OUTLIER -75.06 160.99 29.83 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.603 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 7.9 p -64.1 120.52 12.22 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.696 0.284 . . . . 0.0 111.39 -176.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HD3' ' O ' ' A' ' 65' ' ' LYS . 3.0 tmtp? -73.64 -31.74 63.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.526 0.679 . . . . 0.0 109.168 177.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -84.73 -165.4 1.17 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.215 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.5 p -157.8 159.85 37.17 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.907 -0.775 . . . . 0.0 108.907 176.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.446 ' HB2' ' HB2' ' A' ' 76' ' ' CYS . 22.8 t -67.42 -23.43 65.55 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.054 0.454 . . . . 0.0 110.509 -172.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -68.1 -9.09 43.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.696 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.2 p -133.42 1.24 3.42 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 28.8 m -122.64 140.51 52.75 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -81.09 57.3 3.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.928 0.87 . . . . 0.0 110.407 -177.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -154.32 124.71 6.95 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.231 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -100.35 0.16 39.47 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.357 -176.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -88.45 53.24 2.66 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.467 ' SG ' ' HB3' ' A' ' 78' ' ' ASN . 49.7 t -84.55 129.98 34.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.59 -1.187 . . . . 0.0 111.154 -172.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -80.13 -17.42 52.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.001 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.467 ' HB3' ' SG ' ' A' ' 76' ' ' CYS . 39.0 t30 -57.97 136.86 57.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.508 -177.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.7 mt -81.86 -56.52 3.92 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.859 -179.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.417 ' HB2' ' CE2' ' A' ' 98' ' ' TYR . 3.9 mm? -85.34 79.36 9.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.715 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -73.5 138.71 45.23 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.562 0.696 . . . . 0.0 110.67 -176.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 95.55 -8.58 68.91 Favored Glycine 0 N--CA 1.443 -0.837 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.956 -171.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.462 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 74.4 m-85 -122.78 168.91 11.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 110.197 -0.298 . . . . 0.0 110.197 178.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.415 ' HB2' ' CE1' ' A' ' 99' ' ' TYR . 15.7 m170 -128.41 149.12 70.69 Favored Pre-proline 0 C--O 1.236 0.383 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 170.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -70.74 142.67 44.14 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.78 2.32 . . . . 0.0 112.866 -179.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.484 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 16.6 ttmm -133.48 137.19 45.55 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.179 177.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 88.1 mt -83.66 130.63 34.97 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.198 176.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.425 HG21 ' HG2' ' A' ' 97' ' ' GLU . 16.0 m -132.11 149.86 33.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.48 178.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.6 p -97.64 118.03 43.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-O 121.201 0.524 . . . . 0.0 110.697 179.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -122.31 98.04 5.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.014 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 66.53 -112.01 4.58 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.995 -177.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.46 ' HD3' ' HE2' ' A' ' 49' ' ' MET . 17.7 mmt180 -112.6 15.49 20.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.155 0.503 . . . . 0.0 110.512 176.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.9 p -125.78 131.12 52.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.075 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 68.5 mt -91.04 129.16 42.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 177.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -119.27 177.83 4.75 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.952 0.406 . . . . 0.0 110.847 -170.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.505 HD11 ' O ' ' A' ' 56' ' ' LYS . 56.5 mt -127.7 106.87 15.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.587 -177.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.425 ' HG2' HG21 ' A' ' 88' ' ' VAL . 57.3 mm-40 -97.31 178.9 5.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.433 176.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 80' ' ' LEU . 24.4 m-85 -132.16 130.71 41.45 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.159 0.504 . . . . 0.0 111.12 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.484 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 38.0 p90 -113.41 150.87 32.1 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.381 174.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.462 ' HG2' ' CE1' ' A' ' 83' ' ' TYR . 36.8 mt-10 -64.62 131.48 47.1 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.657 0.265 . . . . 0.0 110.907 -177.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.518 ' SG ' HG12 ' A' ' 103' ' ' VAL . 47.7 t -44.63 122.56 4.54 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.889 177.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.53 -12.67 21.82 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 123.241 2.627 . . . . 0.0 113.849 -175.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.518 HG12 ' SG ' ' A' ' 101' ' ' CYS . 4.5 p -67.77 -19.02 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 120.765 0.316 . . . . 0.0 110.525 178.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -66.9 -21.82 65.99 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-O 121.068 0.461 . . . . 0.0 110.515 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -78.04 91.33 4.25 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 178.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.8 mmmm . . . . . 0 C--N 1.322 -0.619 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.914 -175.856 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.406 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 26.6 ptt? . . . . . 0 N--CA 1.482 1.139 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -115.68 86.83 16.35 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 177.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 1' ' ' MET . 8.3 Cg_exo -71.96 110.03 2.82 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 123.049 2.499 . . . . 0.0 112.673 -176.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.8 mm -87.84 -31.88 5.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-O 121.614 0.721 . . . . 0.0 109.51 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -82.43 63.86 4.36 Favored Glycine 0 N--CA 1.447 -0.631 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.882 178.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -97.87 2.64 49.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.944 0.402 . . . . 0.0 111.057 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.2 m -81.95 68.52 8.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.023 0.44 . . . . 0.0 110.422 178.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.409 HD13 ' HA ' ' A' ' 8' ' ' LEU . 3.2 mm? -75.85 4.46 8.04 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.486 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -78.17 -34.76 49.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 61.88 -163.31 24.87 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 115.639 -0.709 . . . . 0.0 113.244 176.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 7.9 m -136.51 124.11 33.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.868 0.366 . . . . 0.0 110.115 178.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.2 t -74.96 -26.54 59.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.11 0.481 . . . . 0.0 110.519 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -100.11 129.09 9.78 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 176.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -143.79 84.33 9.89 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-O 121.344 0.592 . . . . 0.0 111.206 -175.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.676 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 55.2 Cg_endo -70.36 134.98 27.95 Favored 'Trans proline' 0 C--N 1.331 -0.365 0 C-N-CA 123.389 2.726 . . . . 0.0 111.913 174.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.55 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 2.1 p-10 -72.55 -22.6 60.98 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -55.48 -53.06 61.06 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.539 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.676 ' HG2' ' HG2' ' A' ' 15' ' ' PRO . 2.0 pt20 -63.66 -31.23 72.33 Favored 'General case' 0 CA--C 1.521 -0.153 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.888 -177.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.55 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 43.1 mtmt -64.36 -36.67 84.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.576 -178.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.466 ' O ' ' HG2' ' A' ' 24' ' ' MET . 8.6 mtt180 -71.77 -50.65 28.05 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 175.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.8 tp -54.21 -49.64 68.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.049 -175.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -74.67 -34.58 62.71 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.97 -178.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.455 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 8.2 tt0 -63.44 -56.19 18.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.777 0.323 . . . . 0.0 110.862 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.608 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.4 ptm -61.7 -37.64 84.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.747 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.551 ' HA ' ' HE3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -66.93 -44.55 80.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.154 178.707 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -65.03 -37.21 86.86 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -58.06 -44.16 87.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.698 175.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.608 HG23 ' O ' ' A' ' 24' ' ' MET . 78.1 t -64.62 -36.08 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.956 178.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.456 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 88.9 mmm -84.97 0.14 52.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.071 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.87 -35.99 13.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.436 0.636 . . . . 0.0 110.331 175.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.692 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 21.7 t70 -62.56 123.49 18.48 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.725 -1.125 . . . . 0.0 112.154 -171.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.439 ' H ' ' CD ' ' A' ' 32' ' ' GLN . 1.0 OUTLIER -60.65 -41.25 94.6 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.395 -176.547 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -63.12 -46.85 85.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.918 -177.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 29.8 t -54.93 -47.11 76.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.404 176.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.692 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 55.5 mt-30 -62.31 -40.63 96.94 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.5 -176.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.54 -40.26 82.49 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.562 177.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.459 ' CE2' HD11 ' A' ' 45' ' ' ILE . 88.5 t80 -69.56 -39.79 77.18 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.397 177.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.579 HD11 HD11 ' A' ' 50' ' ' ILE . 2.6 mm? -63.08 -44.91 94.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.756 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.5 ptmm? -68.51 -29.12 67.65 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.104 0.478 . . . . 0.0 110.527 -177.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -80.47 -30.42 37.43 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.987 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -119.14 26.55 9.41 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -176.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -65.4 -17.64 64.69 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.097 0.475 . . . . 0.0 110.18 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.84 -31.76 69.81 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.118 178.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.5 t -108.19 -35.43 2.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.492 -172.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.459 HD11 ' CE2' ' A' ' 37' ' ' PHE . 68.9 mt -78.3 135.67 25.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.558 0.694 . . . . 0.0 111.516 -175.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -111.44 164.98 12.37 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.74 178.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.401 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 76.7 mt-30 -61.51 -37.23 82.94 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.347 0.594 . . . . 0.0 109.658 173.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -63.07 -42.2 99.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.276 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 33.6 tpp -56.21 -42.29 76.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.289 176.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.579 HD11 HD11 ' A' ' 38' ' ' LEU . 35.9 mm -60.32 -39.35 80.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.517 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.516 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 41.8 mt-10 -65.58 -49.19 69.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.487 176.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -60.65 -47.16 87.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.14 -177.027 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.3 p -92.79 17.66 10.1 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.329 -175.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.516 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -52.45 -49.37 64.76 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.96 0.409 . . . . 0.0 110.786 -179.473 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -61.74 -42.32 98.81 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.681 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -61.15 -51.36 69.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.806 0.336 . . . . 0.0 110.388 179.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 57' ' ' LEU . 3.9 mm? -59.95 -43.31 95.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.054 179.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -66.21 -42.62 88.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.411 -177.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -59.59 -36.43 76.26 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.352 0.596 . . . . 0.0 110.021 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -67.23 -45.38 76.94 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.885 -178.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 28.6 pt -75.36 -31.4 23.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -174.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -81.07 -27.05 35.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.589 0.233 . . . . 0.0 111.29 -177.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -80.25 173.99 12.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.055 0.455 . . . . 0.0 111.117 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.6 m -76.7 116.04 17.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.704 -179.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -81.02 -35.76 31.47 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.129 0.49 . . . . 0.0 110.111 176.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -79.86 -177.02 5.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.952 177.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -150.79 156.81 42.02 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.116 -0.634 . . . . 0.0 110.632 -177.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.492 ' H ' ' CD ' ' A' ' 81' ' ' GLU . 33.1 t -66.98 -19.01 65.65 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.223 -172.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.483 ' CE1' ' HA ' ' A' ' 104' ' ' LYS . 1.2 t80 -75.9 -2.23 29.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.066 0.46 . . . . 0.0 111.305 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 17.6 p -132.24 -44.28 0.94 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.559 176.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.6 p -80.53 152.09 28.84 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -81.97 -9.79 59.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.818 0.342 . . . . 0.0 110.768 -176.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.482 ' HB2' ' HB2' ' A' ' 76' ' ' CYS . 7.4 m-20 -55.0 111.82 0.92 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.222 -175.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -70.4 -21.74 62.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.449 0.643 . . . . 0.0 109.273 171.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -86.98 4.84 40.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.563 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.482 ' HB2' ' HB2' ' A' ' 73' ' ' ASP . 45.8 t -69.3 114.37 7.48 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.07 0.462 . . . . 0.0 110.506 -178.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -117.22 143.85 45.43 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -160.49 168.41 25.15 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.0 mt -75.26 -79.22 0.1 Allowed 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.407 ' HB2' ' CD2' ' A' ' 98' ' ' TYR . 8.0 mp -88.34 93.86 9.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.206 173.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.492 ' CD ' ' H ' ' A' ' 68' ' ' SER . 2.2 mm-40 -76.19 151.52 36.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.354 0.597 . . . . 0.0 110.714 179.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.38 -9.74 72.01 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.028 -170.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.559 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 64.9 m-85 -122.47 172.12 8.59 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.491 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 14.5 m170 -128.92 144.35 52.19 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 172.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -75.34 130.76 13.22 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 122.446 2.097 . . . . 0.0 111.252 174.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.557 ' HD3' ' CD1' ' A' ' 99' ' ' TYR . 19.9 pttp -134.99 148.5 49.99 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.007 0.432 . . . . 0.0 109.994 175.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.415 HD23 HG12 ' A' ' 96' ' ' ILE . 73.2 mt -81.26 141.62 33.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.346 -175.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 27.7 m -135.95 154.23 33.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.562 175.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.6 p -107.05 114.02 45.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.343 0.592 . . . . 0.0 110.346 176.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -125.89 101.97 7.07 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.302 -177.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 67.73 -118.5 9.86 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.861 -0.608 . . . . 0.0 112.211 -179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 92' ' ' ARG . 20.7 tpp180 -105.2 19.52 20.45 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.978 0.894 . . . . 0.0 109.947 -179.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 43.3 t -136.16 136.53 40.1 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.25 0.548 . . . . 0.0 111.433 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 86.3 mt -89.61 119.54 36.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 169.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -113.57 177.71 4.54 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 120.852 0.358 . . . . 0.0 110.634 -172.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.415 HG12 HD23 ' A' ' 87' ' ' LEU . 53.3 mt -131.64 115.98 29.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.309 -177.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -119.03 163.28 17.21 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 174.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.559 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 30.3 m-85 -103.92 141.21 36.55 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.096 -176.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.557 ' CD1' ' HD3' ' A' ' 86' ' ' LYS . 53.6 p90 -117.69 147.55 42.81 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 173.08 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.479 ' HG2' ' CE2' ' A' ' 83' ' ' TYR . 31.5 mt-10 -62.58 125.83 25.27 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.395 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.619 ' HB3' ' HB2' ' A' ' 104' ' ' LYS . 40.0 t -47.31 132.43 9.82 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.235 175.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -55.58 -29.29 69.26 Favored 'Trans proline' 0 CA--C 1.529 0.274 0 C-N-CA 122.537 2.158 . . . . 0.0 112.085 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 5.0 t -80.16 -17.9 12.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.38 178.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.619 ' HB2' ' HB3' ' A' ' 101' ' ' CYS . 14.2 tmtt? -81.67 -34.89 30.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.524 -179.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 54.0 mtm180 -73.88 99.64 3.28 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.394 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 20.5 pttp . . . . . 0 C--N 1.319 -0.735 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.511 -176.023 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 121.211 0.529 . . . . 0.0 110.335 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -142.96 165.81 24.03 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.518 -0.765 . . . . 0.0 109.558 -176.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -66.54 86.86 0.27 Allowed 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 121.95 1.767 . . . . 0.0 110.78 170.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.1 mm -79.12 -40.13 21.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.078 -176.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 159.69 128.18 0.96 Allowed Glycine 0 N--CA 1.443 -0.839 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.487 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.65 14.82 27.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.221 0.534 . . . . 0.0 110.577 179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.4 t -118.05 99.31 6.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.308 177.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -76.04 -41.54 50.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.144 0.497 . . . . 0.0 109.726 -177.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.409 ' H ' ' CD ' ' A' ' 9' ' ' GLN . 0.5 OUTLIER -108.5 -175.0 2.65 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.01 -178.005 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -100.83 91.8 1.0 Allowed Glycine 0 N--CA 1.447 -0.581 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.515 177.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.4 t -61.72 106.27 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.137 0.494 . . . . 0.0 110.5 -178.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -107.67 8.81 29.22 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.918 -176.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.465 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -119.63 117.08 3.48 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 111.317 -0.713 . . . . 0.0 111.317 175.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.465 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.0 OUTLIER -143.49 85.24 9.55 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 -177.051 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.446 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 20.3 Cg_endo -60.97 154.48 56.38 Favored 'Trans proline' 0 C--O 1.236 0.416 0 C-N-CA 122.951 2.434 . . . . 0.0 111.996 176.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 55.4 m-20 -58.44 -28.4 65.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.892 -178.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -55.85 -50.54 70.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.395 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -71.2 -34.3 70.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.895 0.378 . . . . 0.0 110.184 -176.878 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -62.47 -47.63 83.14 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.776 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.508 ' O ' ' HG2' ' A' ' 24' ' ' MET . 12.7 ptm180 -72.57 -32.34 65.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.563 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.632 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 36.4 tp -64.85 -50.28 67.26 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.152 -178.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -67.02 -29.92 69.87 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.272 0.558 . . . . 0.0 110.309 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.41 HE21 ' HA ' ' A' ' 20' ' ' ARG . 8.6 tt0 -67.69 -54.75 16.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.5 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.508 ' HG2' ' O ' ' A' ' 20' ' ' ARG . 25.7 ptm -68.66 -34.63 76.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.068 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.632 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 12.3 tptm -56.69 -51.79 67.44 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.312 0.577 . . . . 0.0 110.308 178.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.48 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 41.2 tt0 -65.41 -36.33 83.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.647 -179.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.402 ' HE3' ' CE1' ' A' ' 58' ' ' TYR . 18.7 mtpp -62.94 -36.45 83.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.731 178.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 24' ' ' MET . 95.9 t -70.73 -38.55 73.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 121.178 0.513 . . . . 0.0 109.738 177.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 25.9 mmt -77.36 5.27 9.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.042 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 1.9 mptp? -101.53 -13.7 17.78 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.775 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.675 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 35.5 t70 -85.6 142.59 29.0 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.257 0.551 . . . . 0.0 111.927 -172.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -72.48 -44.2 62.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.463 -176.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -67.8 -38.56 83.46 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 -178.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.424 ' O ' HD23 ' A' ' 38' ' ' LEU . 46.2 t -53.71 -46.54 62.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.873 175.199 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.675 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 59.0 mm-40 -57.92 -52.36 65.8 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 121.048 0.451 . . . . 0.0 110.852 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.29 -40.46 97.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.516 -176.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 92.1 t80 -63.71 -40.05 95.83 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.635 178.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.531 HD11 HD11 ' A' ' 50' ' ' ILE . 2.2 mm? -62.13 -49.32 76.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.371 -179.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.9 ptmm? -66.71 -28.09 68.15 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.249 0.547 . . . . 0.0 110.804 -177.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.44 -33.33 54.82 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.563 -178.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -119.16 25.67 10.0 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.393 -175.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -70.0 -17.02 63.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.636 0.255 . . . . 0.0 111.616 -175.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -71.79 -39.89 69.58 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 177.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 18.1 t -93.41 -41.44 12.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.737 -172.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.493 HG12 ' SD ' ' A' ' 49' ' ' MET . 64.9 mt -92.92 141.74 14.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.029 -176.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.49 ' O ' HG12 ' A' ' 50' ' ' ILE . 0.9 OUTLIER -131.54 -179.21 5.23 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 -179.93 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -61.12 -36.85 80.84 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.539 0.2 . . . . 0.0 111.539 -177.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -62.27 -48.74 78.6 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.493 ' SD ' HG12 ' A' ' 45' ' ' ILE . 44.5 ttm -60.1 -35.97 76.38 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.774 178.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.531 HD11 HD11 ' A' ' 38' ' ' LEU . 36.6 mm -63.53 -47.8 89.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.056 178.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -70.37 -30.56 67.51 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.951 0.405 . . . . 0.0 110.766 -178.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.474 ' N ' ' HE3' ' A' ' 52' ' ' LYS . 0.1 OUTLIER -75.49 -40.9 56.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.041 179.189 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.461 ' HB2' HD12 ' A' ' 94' ' ' ILE . 15.4 m -95.87 21.3 8.74 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.475 178.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.2 tp -59.13 -40.75 86.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.408 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -59.68 -41.55 90.94 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.363 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.515 ' O ' HD11 ' A' ' 96' ' ' ILE . 73.7 mmtt -64.01 -53.44 49.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.759 178.631 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.405 HD11 HG21 ' A' ' 94' ' ' ILE . 11.0 mp -61.06 -39.12 88.66 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.151 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.402 ' CE1' ' HE3' ' A' ' 27' ' ' LYS . 32.3 t80 -67.49 -40.95 85.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.774 179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -64.49 -37.8 88.81 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.342 0.591 . . . . 0.0 109.9 177.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 54.9 t80 -65.33 -47.1 77.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.162 -177.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.552 ' HA ' ' HE3' ' A' ' 65' ' ' LYS . 23.7 pt -70.32 -30.51 43.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 C-N-CA 121.148 -0.221 . . . . 0.0 111.508 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -81.34 -25.19 36.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.795 -179.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 2.2 pt20 -82.51 156.0 24.26 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.693 -178.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 14.5 m -62.48 109.46 1.38 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.455 -177.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.552 ' HE3' ' HA ' ' A' ' 61' ' ' ILE . 93.7 mttt -83.26 -41.0 18.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.911 178.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 18.4 p-10 -78.75 171.53 15.02 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.167 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -141.16 154.01 45.65 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -178.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.552 ' HB2' ' OE2' ' A' ' 81' ' ' GLU . 72.5 m -74.31 -11.45 60.27 Favored 'General case' 0 C--N 1.311 -1.078 0 O-C-N 123.507 0.504 . . . . 0.0 111.442 -170.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -75.21 -0.43 19.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.001 174.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 28.6 p -143.67 -28.19 0.53 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.761 176.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.496 ' O ' ' HA ' ' A' ' 68' ' ' SER . 16.5 m -114.16 151.19 33.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -100.31 7.36 44.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.585 0.231 . . . . 0.0 111.211 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -56.13 104.36 0.14 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.369 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -83.01 -23.92 33.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.821 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -92.73 29.68 1.72 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.492 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 31.1 p -134.4 126.62 29.93 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 174.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -83.38 120.89 26.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.302 0.572 . . . . 0.0 109.834 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -111.06 109.83 20.1 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.316 0.579 . . . . 0.0 109.879 174.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.5 tt -57.65 -61.41 2.53 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.108 179.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.2 mp -86.47 162.95 17.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.574 173.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.552 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 6.8 tp10 -141.07 145.57 36.01 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 176.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 77.93 6.92 87.51 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -169.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.659 ' HB3' ' HD2' ' A' ' 98' ' ' TYR . 78.5 m-85 -134.51 154.98 51.16 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.76 0.314 . . . . 0.0 110.881 -178.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.404 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 18.8 m170 -130.48 146.07 60.18 Favored Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 174.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.462 ' CG ' ' HA ' ' A' ' 65' ' ' LYS . 69.7 Cg_endo -78.05 143.16 20.15 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 122.191 1.927 . . . . 0.0 111.82 174.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -144.15 150.74 38.54 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 176.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 97.5 mt -75.75 137.57 40.67 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.025 176.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.455 HG21 ' OE2' ' A' ' 97' ' ' GLU . 30.2 m -130.58 148.52 33.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 116.28 -0.418 . . . . 0.0 109.931 177.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.3 p -87.87 116.27 29.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.555 0.693 . . . . 0.0 109.551 175.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.31 95.88 5.28 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.098 -176.051 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 65.81 -108.31 2.33 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.849 -176.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -117.67 19.29 13.92 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.306 0.574 . . . . 0.0 109.985 177.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 11.6 p -132.48 160.49 36.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.003 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.461 HD12 ' HB2' ' A' ' 53' ' ' SER . 47.1 mt -104.67 134.65 45.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -125.49 178.14 5.8 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -175.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.515 HD11 ' O ' ' A' ' 56' ' ' LYS . 26.9 mt -130.83 113.71 25.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.882 -178.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.455 ' OE2' HG21 ' A' ' 88' ' ' VAL . 32.8 mt-10 -126.85 159.38 34.07 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.585 -0.279 . . . . 0.0 110.287 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.659 ' HD2' ' HB3' ' A' ' 83' ' ' TYR . 8.0 m-85 -99.31 136.08 39.78 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.981 0.42 . . . . 0.0 112.026 -175.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -115.19 158.62 22.01 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 173.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.91 139.37 43.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.749 0.309 . . . . 0.0 110.614 -175.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 33.0 t -55.07 121.82 38.42 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.117 177.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.61 -9.25 25.56 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.374 2.05 . . . . 0.0 112.576 -177.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 33.4 t -82.01 -13.53 12.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.182 179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.9 tptp -77.51 -26.94 51.61 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.85 -178.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -134.35 112.03 10.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.853 0.358 . . . . 0.0 110.153 -177.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.678 -179.492 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.2 tpt . . . . . 0 N--CA 1.477 0.888 0 CA-C-O 120.796 0.331 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -169.76 86.28 0.58 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.751 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.51 85.92 0.45 Allowed 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 122.243 1.962 . . . . 0.0 111.924 177.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.5 tt -136.25 133.6 49.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.236 0.541 . . . . 0.0 110.931 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -128.82 90.44 0.32 Allowed Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 111.006 -0.837 . . . . 0.0 111.006 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 30.5 mtp180 -75.87 126.89 31.87 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.001 0.429 . . . . 0.0 110.764 -174.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.1 m -85.13 78.79 9.78 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.932 -178.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 41.6 tp -81.57 73.52 8.61 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 175.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -161.32 155.19 22.16 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.358 -176.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -151.38 -169.8 17.47 Favored Glycine 0 N--CA 1.447 -0.612 0 N-CA-C 111.436 -0.666 . . . . 0.0 111.436 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.8 t -84.06 105.78 13.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.248 0.547 . . . . 0.0 109.904 -179.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 22.9 m -147.05 157.58 43.66 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.409 ' C ' ' HD3' ' A' ' 14' ' ' ARG . . . -75.89 161.64 52.39 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.754 177.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.409 ' HD3' ' C ' ' A' ' 13' ' ' GLY . 0.2 OUTLIER -141.96 84.24 12.01 Favored Pre-proline 0 C--N 1.326 -0.432 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 -179.0 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.461 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 15.0 Cg_endo -58.46 132.67 49.92 Favored 'Trans proline' 0 C--O 1.233 0.234 0 C-N-CA 122.927 2.418 . . . . 0.0 111.522 175.39 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.945 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 9.9 t70 -69.73 -24.9 63.61 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.639 -176.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -53.26 -55.97 20.31 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.485 178.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.565 ' HA ' ' HB3' ' A' ' 21' ' ' LEU . 2.3 pt20 -66.17 -31.22 71.94 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.739 0.304 . . . . 0.0 110.761 -177.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.945 ' HD3' ' HA ' ' A' ' 16' ' ' ASP . 50.4 mtpt -58.27 -42.12 85.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.388 177.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.707 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 23.2 mtp180 -78.8 -41.36 30.54 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.902 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.565 ' HB3' ' HA ' ' A' ' 18' ' ' GLN . 30.1 tp -54.27 -49.75 68.85 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.737 179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -75.92 -28.52 58.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.018 0.437 . . . . 0.0 110.759 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.484 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 7.7 tt0 -62.41 -55.27 29.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.913 176.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.472 ' O ' HG23 ' A' ' 28' ' ' VAL . 27.1 ptm -62.99 -35.86 81.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.755 -179.194 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.672 ' O ' ' HG2' ' A' ' 29' ' ' MET . 4.1 tppp? -55.82 -53.86 51.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 173.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.63 ' O ' ' HG2' ' A' ' 30' ' ' LYS . 2.3 tt0 -55.07 -48.16 73.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.651 178.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.442 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 12.5 mmmt -51.84 -42.23 62.43 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.661 -0.7 . . . . 0.0 112.064 178.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.564 ' HA ' HD13 ' A' ' 61' ' ' ILE . 78.6 t -69.89 -37.61 73.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-O 121.212 0.53 . . . . 0.0 110.3 -177.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.672 ' HG2' ' O ' ' A' ' 25' ' ' LYS . 29.1 mmm -75.23 5.82 5.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.557 -178.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.63 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 30.5 mmtp -102.81 -18.27 15.19 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.657 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 23.1 t70 -81.27 129.28 34.54 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.731 -0.388 . . . . 0.0 111.142 -175.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -62.66 -36.58 83.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.826 -0.624 . . . . 0.0 112.2 -175.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -73.74 -36.75 65.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.834 0.35 . . . . 0.0 110.402 -179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 32.8 t -57.72 -50.09 78.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.406 173.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 45.8 mt-30 -61.32 -41.29 96.76 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.577 179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.433 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -58.86 -40.84 85.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.67 177.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -67.79 -41.39 83.25 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.765 177.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.485 HD11 HD11 ' A' ' 50' ' ' ILE . 1.9 mm? -60.75 -45.37 94.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.366 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -72.87 -25.1 60.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.01 0.433 . . . . 0.0 110.797 -178.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.1 OUTLIER -78.85 -32.13 45.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.683 -177.512 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -122.73 28.33 7.35 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.278 -178.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -62.84 -23.86 67.5 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.935 0.398 . . . . 0.0 111.43 -178.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -70.79 -32.95 70.22 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.289 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.9 t -94.74 -44.53 13.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.926 -172.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 57.6 mt -79.8 142.87 13.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.328 -174.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -127.95 176.3 7.7 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.423 175.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.561 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 49.1 mt-30 -58.77 -46.4 87.57 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -177.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -60.01 -40.0 87.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.756 0.312 . . . . 0.0 111.297 -178.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.486 ' HG2' HG13 ' A' ' 94' ' ' ILE . 44.1 ttm -60.06 -43.39 95.46 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.476 177.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.485 HD11 HD11 ' A' ' 38' ' ' LEU . 38.2 mm -62.79 -44.71 99.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.061 178.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 47' ' ' GLN . 13.7 mm-40 -61.89 -36.42 81.23 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.595 -177.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 30.9 mtmt -75.31 -44.17 46.92 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.793 178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.495 ' CB ' ' HB ' ' A' ' 94' ' ' ILE . 26.0 m -91.93 19.65 6.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.588 -174.316 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 45.9 tp -62.47 -37.9 87.75 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.853 0.358 . . . . 0.0 110.317 178.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.0 p-10 -62.18 -39.99 94.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.352 176.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.571 ' O ' HD11 ' A' ' 96' ' ' ILE . 70.2 mmtt -61.53 -53.32 57.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.1 0.476 . . . . 0.0 110.885 178.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.16 -36.58 84.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.354 -177.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -69.58 -42.42 74.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.796 0.331 . . . . 0.0 110.157 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -56.18 -42.8 77.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.965 175.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.49 ' HA ' HE21 ' A' ' 63' ' ' GLN . 76.2 t80 -61.52 -46.97 87.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.085 -0.961 . . . . 0.0 112.418 -177.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.564 HD13 ' HA ' ' A' ' 28' ' ' VAL . 36.2 pt -75.38 -31.14 23.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 112.106 0.409 . . . . 0.0 112.106 -175.226 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -84.1 -19.33 34.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.762 0.315 . . . . 0.0 111.078 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.49 HE21 ' HA ' ' A' ' 60' ' ' TYR . 24.7 pt20 -88.08 -178.05 5.88 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 173.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.0 m -71.75 124.62 25.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.118 0.485 . . . . 0.0 111.345 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -78.17 -27.09 47.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.922 174.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.555 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 79.0 m-20 -99.92 -164.6 1.14 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.02 -0.991 . . . . 0.0 110.005 175.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.7 p -146.18 156.77 43.64 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 176.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 t -66.0 -13.34 59.69 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.212 0.529 . . . . 0.0 111.12 -173.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -78.49 -3.4 43.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.733 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.4 p -134.77 -38.92 0.8 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.235 176.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 31.1 p -83.39 130.55 35.05 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 177.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.423 ' H ' ' HG2' ' A' ' 72' ' ' GLU . 7.2 pt-20 -95.98 0.58 51.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.25 0.548 . . . . 0.0 110.989 -176.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -75.31 104.22 5.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.374 171.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -82.92 5.85 20.52 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.772 -175.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 44.5 m-80 -70.45 -40.18 73.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.913 0.387 . . . . 0.0 110.378 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 72.5 m -86.96 113.62 22.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.593 176.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.5 p30 -105.42 144.58 32.0 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 173.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.678 ' HB3' ' HG ' ' A' ' 80' ' ' LEU . 44.1 m-80 -142.13 158.21 44.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.16 -175.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 4.3 pp -76.43 -22.14 55.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.367 0.603 . . . . 0.0 109.399 171.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.678 ' HG ' ' HB3' ' A' ' 78' ' ' ASN . 2.6 pp -82.42 126.24 31.98 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.259 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -143.55 118.01 9.7 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.961 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.27 -8.18 68.8 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.844 -176.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.436 ' CE1' ' HG2' ' A' ' 100' ' ' GLU . 89.8 m-85 -126.28 162.19 26.04 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.555 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 16.1 m170 -125.92 148.54 63.04 Favored Pre-proline 0 CA--C 1.514 -0.416 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.419 ' O ' ' HE1' ' A' ' 60' ' ' TYR . 42.2 Cg_endo -69.81 144.27 53.24 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.226 1.951 . . . . 0.0 111.593 175.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.478 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 59.9 tttp -146.75 134.15 20.75 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.25 -178.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.408 HD22 ' H ' ' A' ' 87' ' ' LEU . 2.0 mm? -71.74 131.54 43.25 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 178.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.401 HG21 ' HG2' ' A' ' 97' ' ' GLU . 35.1 m -129.13 152.15 36.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.131 177.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.2 p -99.15 112.1 30.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.366 0.603 . . . . 0.0 109.55 173.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -110.19 96.82 6.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.819 -178.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.36 -99.87 0.68 Allowed Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.527 -177.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -118.63 3.41 11.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.665 0.269 . . . . 0.0 111.405 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 33.4 t -124.35 150.69 45.22 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.784 0.326 . . . . 0.0 110.826 -176.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.495 ' HB ' ' CB ' ' A' ' 53' ' ' SER . 66.5 mt -94.33 139.13 19.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 176.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -135.57 178.39 7.08 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -175.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.571 HD11 ' O ' ' A' ' 56' ' ' LYS . 65.6 mt -121.16 101.34 10.35 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.616 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.401 ' HG2' HG21 ' A' ' 88' ' ' VAL . 35.4 mm-40 -95.97 -170.46 2.13 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.672 176.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.435 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 43.7 m-85 -133.65 141.89 47.81 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.281 0.562 . . . . 0.0 111.71 -175.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.478 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 46.0 p90 -122.26 151.39 41.13 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.213 172.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.436 ' HG2' ' CE1' ' A' ' 83' ' ' TYR . 41.5 mt-10 -65.77 127.76 33.27 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.193 -177.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.47 ' SG ' HG12 ' A' ' 103' ' ' VAL . 49.8 t -48.34 123.31 10.76 Favored Pre-proline 0 N--CA 1.463 0.219 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.482 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -67.83 5.57 1.02 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 123.266 2.644 . . . . 0.0 113.886 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.47 HG12 ' SG ' ' A' ' 101' ' ' CYS . 5.9 p -86.33 -19.54 8.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 O-C-N 122.1 -0.375 . . . . 0.0 110.464 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.0 mtmt -67.98 -51.63 45.13 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.298 -176.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -136.05 30.26 3.04 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.185 -178.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.7 mttm . . . . . 0 C--O 1.236 0.363 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.144 -178.545 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.9 mmm . . . . . 0 N--CA 1.481 1.123 0 CA-C-O 120.896 0.379 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.507 ' OE1' ' HD2' ' A' ' 6' ' ' ARG . 26.7 mt-10 -138.91 153.07 71.52 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.682 -178.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -75.34 177.46 8.62 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.667 2.244 . . . . 0.0 112.998 -178.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.489 HD13 ' O ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -78.3 4.09 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 CA-C-O 121.881 0.848 . . . . 0.0 110.287 -177.107 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -61.76 -20.31 59.48 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.209 177.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.507 ' HD2' ' OE1' ' A' ' 2' ' ' GLU . 20.8 mtp180 -75.3 79.03 2.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.806 0.336 . . . . 0.0 110.163 175.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.5 m -84.97 93.99 8.69 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.178 0.513 . . . . 0.0 110.724 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 48.6 tp -68.68 -26.95 65.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.934 179.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -87.76 14.88 7.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.105 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.55 -14.95 80.72 Favored Glycine 0 N--CA 1.451 -0.36 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.455 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 43.1 t -83.17 97.83 4.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 176.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 p -68.55 -58.19 4.66 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.759 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -148.9 126.99 2.38 Favored Glycine 0 N--CA 1.444 -0.78 0 C-N-CA 120.376 -0.916 . . . . 0.0 112.664 -179.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.45 ' HA ' ' HD2' ' A' ' 15' ' ' PRO . 17.8 ttt180 -154.89 85.8 3.55 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 175.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.45 ' HD2' ' HA ' ' A' ' 14' ' ' ARG . 8.5 Cg_endo -48.74 137.09 27.38 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 124.141 3.227 . . . . 0.0 113.646 -174.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.576 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 6.3 p-10 -63.71 -21.37 66.36 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.624 178.502 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -53.61 -58.62 6.52 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.702 175.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.402 HE21 ' HB2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -71.87 -30.8 65.8 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.768 -178.892 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.576 ' HE2' ' HA ' ' A' ' 16' ' ' ASP . 52.9 mtmt -64.08 -45.55 88.21 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 121.066 -0.254 . . . . 0.0 110.672 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -71.87 -37.54 70.17 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.272 -0.27 . . . . 0.0 110.272 178.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 28.4 tp -63.19 -49.92 72.36 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.946 -178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.403 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 75.2 mm-40 -65.95 -35.81 81.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.524 177.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -62.52 -59.11 5.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.161 -178.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.43 ' O ' HG23 ' A' ' 28' ' ' VAL . 22.7 ptm -61.63 -40.49 95.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.938 -177.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.42 ' O ' ' HG2' ' A' ' 29' ' ' MET . 55.3 tptt -62.0 -43.19 99.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.959 0.409 . . . . 0.0 109.978 177.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.423 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 3.2 tp10 -60.53 -46.54 89.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.579 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -64.5 -41.81 96.21 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.171 -176.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 24' ' ' MET . 71.5 t -70.98 -44.51 75.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.082 -175.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.466 ' C ' ' HD3' ' A' ' 30' ' ' LYS . 90.6 mmm -71.07 -15.24 62.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.865 0.364 . . . . 0.0 110.805 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.466 ' HD3' ' C ' ' A' ' 29' ' ' MET . 0.0 OUTLIER -110.48 13.65 22.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.716 -178.761 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.567 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 26.5 t70 -85.41 131.74 34.34 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 170.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -61.31 -38.14 85.77 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.419 0.449 . . . . 0.0 111.845 -174.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -71.38 -47.22 57.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.168 0.509 . . . . 0.0 109.669 -177.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 72.6 t -55.06 -55.13 17.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.496 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.596 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 5.0 pt20 -65.78 -27.73 68.5 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.433 ' HA ' ' NZ ' ' A' ' 39' ' ' LYS . . . -62.79 -45.66 91.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.309 0.576 . . . . 0.0 109.739 173.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -66.81 -40.78 88.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.711 176.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.666 HD11 HD11 ' A' ' 50' ' ' ILE . 1.6 mm? -58.99 -48.88 79.97 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.949 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.596 ' HG2' ' O ' ' A' ' 35' ' ' GLN . 17.9 pttm -73.55 -24.0 60.06 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.434 -0.506 . . . . 0.0 111.015 -178.021 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -69.43 -41.26 76.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.118 0.485 . . . . 0.0 110.229 175.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -115.41 28.99 8.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.526 -174.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -69.2 -14.9 63.24 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.149 0.5 . . . . 0.0 110.62 -178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -67.54 -31.22 71.17 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.677 0.751 . . . . 0.0 109.625 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 26.1 t -106.05 -41.77 6.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.512 -172.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 55.9 mt -87.32 141.71 13.97 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.761 -171.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.403 ' O ' HG12 ' A' ' 50' ' ' ILE . 5.5 p-10 -124.26 178.07 5.53 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.361 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.463 ' O ' ' HB ' ' A' ' 50' ' ' ILE . 77.3 mt-30 -58.88 -46.05 88.75 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.635 0.255 . . . . 0.0 111.156 -178.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 48' ' ' LYS . 27.2 mmtm -68.54 -35.41 77.41 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -174.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 51.9 ttm -59.51 -32.06 69.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 171.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.666 HD11 HD11 ' A' ' 38' ' ' LEU . 42.3 mm -72.18 -46.59 57.56 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.594 177.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 54' ' ' LEU . 1.7 mp0 -58.13 -46.02 86.35 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 120.97 0.414 . . . . 0.0 111.016 175.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 50.3 tptt -58.82 -40.28 83.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.821 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.6 m -104.22 17.83 23.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.981 -175.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.7 OUTLIER -60.02 -43.38 95.31 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.138 0.494 . . . . 0.0 110.114 -177.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -57.58 -40.1 78.23 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.182 176.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.599 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 6.9 mmpt? -71.46 -48.19 50.87 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.633 0.254 . . . . 0.0 111.272 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.503 HD21 HG21 ' A' ' 94' ' ' ILE . 95.1 mt -61.26 -39.71 91.36 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.103 0.478 . . . . 0.0 110.593 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -68.07 -40.12 82.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.243 178.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.73 -37.04 77.85 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.24 176.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -66.35 -43.68 85.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.907 179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.8 pt -75.2 -29.92 22.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 C-N-CA 120.713 -0.395 . . . . 0.0 112.037 -174.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -80.93 -27.05 36.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.699 0.285 . . . . 0.0 111.329 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -80.44 -176.96 5.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.928 0.394 . . . . 0.0 110.693 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 12.1 m -79.09 124.14 28.01 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.165 -176.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -77.67 -27.1 50.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.345 0.593 . . . . 0.0 109.99 171.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -97.97 -167.04 1.46 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.437 178.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -153.53 155.19 35.74 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 178.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.3 m -72.04 -20.08 61.74 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.301 -171.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 10.0 t80 -63.19 -21.09 65.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.167 177.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 16.3 p -115.45 -54.48 2.53 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.923 -0.311 . . . . 0.0 111.515 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -91.65 -179.16 5.27 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.016 -175.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.57 ' H ' ' CD ' ' A' ' 72' ' ' GLU . 0.8 OUTLIER -93.76 24.67 3.99 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.607 -177.59 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -60.56 108.78 0.88 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.333 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -69.6 -15.28 63.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.128 0.489 . . . . 0.0 110.163 178.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -73.54 68.14 1.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.293 0.568 . . . . 0.0 109.865 174.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 40.8 m -85.13 17.32 3.03 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.802 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -92.1 12.84 20.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.229 178.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.657 ' HB2' ' HG2' ' A' ' 81' ' ' GLU . 77.0 m-20 -62.23 110.49 1.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 172.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.548 HD23 ' H ' ' A' ' 79' ' ' LEU . 2.2 pt? -56.19 -50.99 69.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.123 -178.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.448 HD22 ' HG ' ' A' ' 79' ' ' LEU . 3.9 mm? -88.02 62.15 6.69 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.509 0.195 . . . . 0.0 111.0 173.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.657 ' HG2' ' HB2' ' A' ' 78' ' ' ASN . 1.6 mm-40 -72.8 159.75 33.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.959 0.409 . . . . 0.0 110.113 177.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 79.95 -8.66 49.68 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.038 -174.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.431 ' HB3' ' HB3' ' A' ' 98' ' ' TYR . 35.0 m-85 -122.17 172.57 8.17 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.0 m170 -129.76 144.41 52.89 Favored Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 171.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.06 135.5 19.05 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.428 2.085 . . . . 0.0 112.328 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -136.6 133.58 36.48 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 176.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 93.8 mt -71.44 138.38 49.01 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.183 -176.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.439 HG21 ' HG3' ' A' ' 97' ' ' GLU . 30.7 m -134.33 149.92 30.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.821 177.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.6 p -103.58 117.91 49.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-O 121.089 0.471 . . . . 0.0 109.983 174.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -117.97 93.92 4.32 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.765 -177.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 58.62 -87.96 0.02 OUTLIER Glycine 0 CA--C 1.521 0.409 0 CA-C-N 115.463 -0.79 . . . . 0.0 114.461 175.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.832 ' HD3' ' H ' ' A' ' 92' ' ' ARG . 0.0 OUTLIER -99.07 -15.19 19.11 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -170.292 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 31.6 p -148.6 170.73 17.46 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.224 0.535 . . . . 0.0 111.569 -173.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.503 HG21 HD21 ' A' ' 57' ' ' LEU . 59.4 mt -106.78 136.49 41.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.441 -0.799 . . . . 0.0 109.377 -179.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -130.06 179.2 6.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.899 0.38 . . . . 0.0 110.732 -173.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 57.9 mt -127.22 114.11 35.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.259 -178.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.439 ' HG3' HG21 ' A' ' 88' ' ' VAL . 31.6 mt-10 -114.39 153.19 30.29 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 178.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.431 ' HB3' ' HB3' ' A' ' 83' ' ' TYR . 38.2 m-85 -105.68 130.39 53.71 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.123 0.487 . . . . 0.0 111.923 -173.087 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 53.3 p90 -106.67 149.66 27.03 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 171.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -69.75 139.79 53.35 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.214 -0.594 . . . . 0.0 110.701 -174.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.568 ' SG ' HG12 ' A' ' 103' ' ' VAL . 49.2 t -48.07 123.69 10.38 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.241 177.144 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -63.96 -14.02 40.82 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.306 2.671 . . . . 0.0 113.887 -172.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.568 HG12 ' SG ' ' A' ' 101' ' ' CYS . 8.4 p -67.81 -25.17 31.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.977 0.418 . . . . 0.0 110.408 178.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -75.74 -47.39 26.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.679 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 105' ' ' ARG . 0.1 OUTLIER -101.24 90.49 4.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.274 -174.626 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.9 mttp . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.518 -179.745 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.419 ' CG ' ' HD2' ' A' ' 3' ' ' PRO . 26.4 tt0 -112.97 144.15 30.51 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.419 ' HD2' ' CG ' ' A' ' 2' ' ' GLU . 5.9 Cg_endo -48.3 116.62 2.11 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.063 2.509 . . . . 0.0 112.285 177.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.429 ' H ' HD12 ' A' ' 4' ' ' ILE . 4.8 mp -84.69 -29.9 6.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.495 178.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.82 -128.48 8.62 Favored Glycine 0 N--CA 1.444 -0.821 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.254 -177.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.475 ' HB2' ' HG ' ' A' ' 8' ' ' LEU . 9.5 ptt180 -144.84 136.91 25.94 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.958 0.409 . . . . 0.0 110.692 178.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.4 m -90.74 19.09 5.73 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.701 -172.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.475 ' HG ' ' HB2' ' A' ' 6' ' ' ARG . 1.6 pp -86.09 25.94 1.08 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.202 0.525 . . . . 0.0 110.788 177.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -111.95 128.09 56.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.718 -174.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 82.54 -64.05 4.34 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 113.968 172.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 35.2 t -70.11 94.71 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.127 0.489 . . . . 0.0 111.792 -172.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.8 p -98.94 16.49 22.29 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.498 0.665 . . . . 0.0 110.411 175.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -79.2 75.37 2.08 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.483 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -142.65 62.97 13.47 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 178.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.607 ' HD2' ' HG2' ' A' ' 18' ' ' GLN . 41.8 Cg_endo -68.82 159.57 53.23 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 121.721 1.614 . . . . 0.0 110.816 172.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -65.38 -19.44 65.95 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.024 0.44 . . . . 0.0 110.217 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.535 ' O ' ' HG2' ' A' ' 20' ' ' ARG . 81.3 t80 -63.52 -51.79 63.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.839 175.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.607 ' HG2' ' HD2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -71.17 -31.84 68.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -177.514 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -64.14 -48.86 74.38 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.702 177.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 17' ' ' PHE . 6.1 ptp180 -64.89 -31.41 72.63 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 178.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.8 tp -68.67 -49.37 59.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.254 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -65.5 -35.81 81.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.937 0.399 . . . . 0.0 110.03 176.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.423 HE21 ' HA ' ' A' ' 20' ' ' ARG . 9.3 tt0 -60.98 -55.48 32.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.265 179.464 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.411 ' O ' HG23 ' A' ' 28' ' ' VAL . 24.8 ptm -65.27 -38.34 89.99 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.153 -179.182 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.5 tptm -63.56 -41.71 98.39 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.155 0.503 . . . . 0.0 110.013 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.476 ' O ' ' HE3' ' A' ' 30' ' ' LYS . 15.2 tm-20 -58.34 -47.11 84.81 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.954 177.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.8 mmmt -58.63 -55.23 37.77 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.706 177.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 24' ' ' MET . 96.3 t -62.65 -42.21 95.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.949 0.404 . . . . 0.0 111.167 -174.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.5 mmt -77.51 -5.62 50.67 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -174.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.476 ' HE3' ' O ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -127.24 6.51 6.43 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.306 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.588 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 0.8 OUTLIER -84.23 136.91 33.76 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.343 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -60.09 -49.18 78.67 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.325 -169.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -65.24 -35.79 82.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.153 0.502 . . . . 0.0 110.669 -174.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 99.5 t -62.21 -37.82 79.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.095 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.588 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 70.8 mm-40 -58.73 -44.69 90.54 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.321 177.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.99 -48.17 82.53 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.107 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -62.23 -41.83 98.77 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.514 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 38' ' ' LEU . 2.7 mm? -59.8 -42.21 92.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.802 -178.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -82.42 -21.79 35.58 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.61 -0.436 . . . . 0.0 110.881 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -62.3 -50.89 69.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.556 0.693 . . . . 0.0 110.067 175.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -112.83 36.03 3.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.586 -177.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 43' ' ' GLU . 7.3 pt-20 -52.15 -40.54 61.55 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.464 -175.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.442 ' N ' ' HG3' ' A' ' 42' ' ' GLU . 15.2 tp10 -85.49 -13.17 49.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.078 0.466 . . . . 0.0 111.058 -173.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 28.3 t -99.07 -38.25 6.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.112 0.482 . . . . 0.0 110.754 -176.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.8 mt -83.13 150.18 4.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.648 -177.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -124.23 165.52 17.48 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 173.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -60.43 -40.06 89.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.073 0.463 . . . . 0.0 111.502 -175.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.466 ' HD3' ' HA ' ' A' ' 48' ' ' LYS . 68.1 mmtt -73.03 -31.85 64.71 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.579 -178.199 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 54.4 ttm -54.41 -43.77 71.78 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.897 0.379 . . . . 0.0 110.193 171.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 42.6 mm -60.11 -44.19 94.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.751 178.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.528 ' HA ' ' HB2' ' A' ' 54' ' ' LEU . 41.2 mt-10 -70.97 -38.45 72.78 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.759 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -66.57 -23.98 66.28 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.034 0.445 . . . . 0.0 111.372 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.4 m -120.54 25.68 9.62 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.25 176.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.528 ' HB2' ' HA ' ' A' ' 51' ' ' GLU . 51.4 tp -61.58 -34.28 75.32 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.423 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -67.34 -33.49 75.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.031 176.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.439 ' O ' HD11 ' A' ' 96' ' ' ILE . 54.4 mmtt -74.6 -43.77 53.95 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.511 177.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.84 -37.9 80.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.954 0.407 . . . . 0.0 109.989 175.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 23.8 t80 -74.98 -39.21 61.4 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.337 179.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.452 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 40.8 tt0 -63.25 -32.06 73.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.304 0.573 . . . . 0.0 109.858 176.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.487 ' HE1' ' C ' ' A' ' 85' ' ' PRO . 69.0 t80 -63.76 -54.88 28.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.408 178.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 21.5 pt -65.51 -28.91 45.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.936 -174.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.452 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 9.4 pt-20 -78.23 -37.03 46.25 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.044 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -86.33 113.49 22.36 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.693 0.282 . . . . 0.0 111.67 -177.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.483 ' HB2' ' HD3' ' A' ' 85' ' ' PRO . 11.5 m 53.55 62.13 2.79 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.597 173.22 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -63.49 -27.13 69.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 122.177 0.989 . . . . 0.0 108.777 173.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 32.3 p30 -138.52 -157.28 0.76 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.272 -1.331 . . . . 0.0 108.188 173.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 1.6 p -151.25 153.41 34.82 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 170.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.1 t -65.1 -29.87 70.77 Favored 'General case' 0 C--N 1.313 -1.014 0 O-C-N 123.782 0.677 . . . . 0.0 110.373 -170.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -55.79 -36.12 67.05 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.978 178.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 25.2 p -103.72 -6.71 21.26 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 120.867 -0.333 . . . . 0.0 111.57 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.8 t -105.27 168.44 9.07 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -95.05 -13.01 25.56 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -76.0 114.73 14.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.343 178.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -87.41 -22.55 24.94 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 175.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -75.84 75.76 2.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.897 178.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 38.4 t -163.55 133.91 4.4 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.153 -0.931 . . . . 0.0 108.766 178.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -116.29 77.78 1.13 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.029 0.442 . . . . 0.0 111.036 -175.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 -72.25 136.58 46.37 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.358 172.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 46.9 tp -62.84 -67.45 0.42 Allowed 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 176.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.476 ' HB3' ' CD2' ' A' ' 83' ' ' TYR . 6.0 mp -88.08 90.71 8.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.742 170.051 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -83.0 144.84 29.68 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.86 -7.8 78.82 Favored Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 -169.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.476 ' CD2' ' HB3' ' A' ' 80' ' ' LEU . 46.1 m-85 -126.07 164.05 21.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.578 -0.311 . . . . 0.0 110.334 -178.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 14.6 m170 -128.51 154.23 79.4 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 169.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.564 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 71.8 Cg_endo -80.14 165.79 21.2 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.467 2.111 . . . . 0.0 112.167 177.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -152.69 147.22 25.85 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 173.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 60' ' ' TYR . 2.5 mm? -78.52 140.6 38.54 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.447 177.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 28.9 m -137.81 141.05 39.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.579 173.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.5 p -89.17 129.69 39.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.171 0.51 . . . . 0.0 111.168 -178.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -132.3 96.08 3.79 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.736 175.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 72.52 -113.8 4.6 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.753 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.471 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 29.4 mmt180 -111.61 14.09 21.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.113 0.483 . . . . 0.0 110.321 177.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 48.3 t -123.98 148.05 47.27 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.276 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 89.4 mt -110.63 125.94 67.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.032 178.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -109.68 174.78 5.71 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.881 -175.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.439 HD11 ' O ' ' A' ' 56' ' ' LYS . 58.0 mt -126.38 105.74 14.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.625 -176.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.564 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 17.4 mm-40 -95.93 -173.88 2.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.877 178.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -135.61 143.77 45.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.037 0.446 . . . . 0.0 111.098 179.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 31.8 p90 -129.71 155.95 45.07 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 173.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -71.79 137.47 47.66 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.831 0.348 . . . . 0.0 110.598 -178.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.561 ' SG ' HG12 ' A' ' 103' ' ' VAL . 43.9 t -55.82 122.83 48.96 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.108 178.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -71.02 -7.77 22.15 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.956 2.437 . . . . 0.0 113.536 -175.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.561 HG12 ' SG ' ' A' ' 101' ' ' CYS . 3.8 p -69.67 -19.67 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.009 0.433 . . . . 0.0 110.429 178.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -65.78 -25.33 67.21 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 176.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 45.9 mmm-85 -97.25 86.54 3.94 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.57 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.312 -1.026 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.651 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.48 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 24.9 mmt . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -114.94 87.53 15.3 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.963 -176.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.48 ' HD3' ' O ' ' A' ' 1' ' ' MET . 4.4 Cg_exo -73.78 78.19 2.51 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.538 2.159 . . . . 0.0 111.229 175.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 59.3 mt -90.02 -52.54 10.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.084 -177.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -135.58 88.0 0.24 Allowed Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 120.399 -0.905 . . . . 0.0 113.016 -176.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.446 ' O ' ' HG3' ' A' ' 6' ' ' ARG . 11.6 ptp180 -77.07 101.61 6.15 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 173.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.6 p -111.87 29.3 7.99 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.688 -173.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 92.7 mt -78.05 -30.23 49.69 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.288 0.566 . . . . 0.0 110.259 178.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -104.46 112.44 25.5 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.155 -179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.92 -167.11 41.66 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.822 176.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.7 t -81.68 92.6 2.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.204 0.526 . . . . 0.0 109.867 178.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 24.5 p -104.74 88.71 2.98 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.057 176.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.578 ' C ' ' HD2' ' A' ' 14' ' ' ARG . . . 80.81 -167.46 50.03 Favored Glycine 0 N--CA 1.444 -0.827 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.637 -176.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.578 ' HD2' ' C ' ' A' ' 13' ' ' GLY . 7.6 mpt_? -141.65 76.22 20.78 Favored Pre-proline 0 C--N 1.324 -0.528 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.531 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 71.9 Cg_endo -76.01 64.13 6.88 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.74 2.293 . . . . 0.0 112.367 176.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.621 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -66.92 -29.06 68.84 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.951 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -59.14 -50.0 75.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.83 0.348 . . . . 0.0 110.063 178.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.531 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -71.07 -29.25 65.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.161 -179.096 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -63.24 -49.07 75.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.405 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.621 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 20.5 mtm105 -69.03 -40.76 78.44 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 121.456 0.646 . . . . 0.0 109.449 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 34.1 tp -54.54 -49.29 70.64 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.491 -1.231 . . . . 0.0 111.212 177.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -75.45 -28.32 59.25 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.638 177.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.414 ' O ' ' HG3' ' A' ' 27' ' ' LYS . 8.6 tp-100 -62.0 -52.64 63.18 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 177.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.611 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.2 ptm -66.3 -36.43 82.94 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.407 177.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -55.3 -50.0 70.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.942 0.401 . . . . 0.0 110.487 175.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -58.04 -47.04 84.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.503 178.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.42 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 25.9 mtpp -59.8 -42.67 93.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.811 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.612 HG12 HG11 ' A' ' 34' ' ' VAL . 84.5 t -67.81 -36.48 75.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.076 -176.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.4 ptp -82.65 -0.92 49.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.179 0.514 . . . . 0.0 110.387 178.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.5 tptt -91.61 -12.17 35.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.294 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 24.9 t70 -85.48 136.97 33.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.193 -176.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.96 -47.03 75.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.652 -177.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -63.52 -45.37 90.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.036 0.446 . . . . 0.0 110.444 -177.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.612 HG11 HG12 ' A' ' 28' ' ' VAL . 49.7 t -56.41 -56.4 13.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.824 -179.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.521 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 8.2 pt20 -66.13 -29.95 70.35 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -176.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.62 -40.75 97.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.016 0.436 . . . . 0.0 109.932 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.468 ' CE2' HD11 ' A' ' 45' ' ' ILE . 93.1 t80 -70.23 -36.34 74.46 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.95 177.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 38' ' ' LEU . 1.4 mm? -56.84 -49.46 75.37 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.412 178.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.521 ' HG2' ' O ' ' A' ' 35' ' ' GLN . 5.2 ptpp? -77.7 -21.33 52.15 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.237 0.542 . . . . 0.0 110.624 -178.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -64.81 -60.72 2.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.327 174.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -102.48 33.85 3.0 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.737 -174.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -61.62 -20.64 63.58 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.417 178.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -85.89 -16.06 39.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.807 -178.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 41.3 t -109.94 -42.46 5.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.854 0.359 . . . . 0.0 111.591 -173.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.468 HD11 ' CE2' ' A' ' 37' ' ' PHE . 56.3 mt -78.43 144.0 11.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.668 -175.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -106.73 165.39 11.34 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.739 175.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -58.04 -45.15 87.45 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.925 0.393 . . . . 0.0 111.023 176.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.595 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 14.1 mmmm -67.01 -37.35 84.02 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.708 0.766 . . . . 0.0 110.323 -178.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.435 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 19.1 ttt -57.2 -37.61 72.44 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.296 176.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 28.3 mm -63.73 -54.61 29.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.404 178.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.595 ' OE2' ' HE2' ' A' ' 48' ' ' LYS . 2.0 pp20? -63.1 -43.88 97.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.086 0.469 . . . . 0.0 111.414 -178.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.56 ' HE2' ' HA ' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -57.3 -31.91 66.12 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.839 178.124 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 73.3 p -108.92 14.26 24.26 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.457 -178.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.8 tp -59.05 -34.45 71.95 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 120.928 0.394 . . . . 0.0 110.645 -179.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -66.91 -38.25 85.88 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.754 176.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.485 ' O ' HD11 ' A' ' 96' ' ' ILE . 27.8 mmmt -66.04 -47.97 72.6 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.058 0.456 . . . . 0.0 109.944 176.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.792 ' HG ' HD21 ' A' ' 87' ' ' LEU . 11.0 mp -64.64 -35.88 82.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.308 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -69.34 -43.05 74.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.73 0.3 . . . . 0.0 110.247 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.502 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 9.2 tp10 -58.66 -37.19 75.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.815 0.817 . . . . 0.0 109.801 174.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.493 ' HB3' ' O ' ' A' ' 57' ' ' LEU . 87.9 t80 -61.83 -47.85 83.2 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.581 -1.19 . . . . 0.0 111.689 179.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.548 HD13 ' HA ' ' A' ' 28' ' ' VAL . 29.8 pt -76.36 -30.54 19.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -177.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.502 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 10.1 pt-20 -79.85 -20.09 46.82 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.821 -0.352 . . . . 0.0 111.466 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 10.1 pt20 -82.29 175.8 9.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.862 0.363 . . . . 0.0 110.206 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 35.1 m -68.35 102.88 1.49 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.102 0.477 . . . . 0.0 110.963 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.2 tppp? -69.62 -31.15 69.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.282 177.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -93.76 -165.77 1.38 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.049 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -157.58 162.66 38.77 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 178.042 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.516 ' HA ' ' O ' ' A' ' 71' ' ' SER . 8.0 p -69.32 -18.93 63.87 Favored 'General case' 0 C--N 1.318 -0.768 0 O-C-N 123.48 0.487 . . . . 0.0 111.908 -174.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -77.83 4.98 10.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.109 0.48 . . . . 0.0 110.946 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 26.1 p -145.51 -44.51 0.21 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.712 175.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' A' ' 68' ' ' SER . 2.5 m -105.32 125.37 50.91 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -87.44 11.02 15.66 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.011 0.434 . . . . 0.0 111.232 -177.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.65 115.16 3.42 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.924 177.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -86.52 -5.3 59.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.679 176.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -60.95 -47.58 85.8 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.9 -177.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 19.0 p -101.28 143.73 30.99 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.8 -176.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -94.95 104.55 16.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.06 0.457 . . . . 0.0 110.238 176.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.33 103.34 11.03 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 174.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 48.6 tp -52.53 -61.95 1.95 Allowed 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.727 -177.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.612 ' HB3' ' HB2' ' A' ' 83' ' ' TYR . 4.5 mm? -84.89 87.38 7.34 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 175.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.28 128.52 36.52 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.561 0.696 . . . . 0.0 110.785 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.25 -9.66 65.2 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.354 -175.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.612 ' HB2' ' HB3' ' A' ' 80' ' ' LEU . 37.0 m-85 -117.39 168.39 10.4 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 122.473 0.309 . . . . 0.0 110.517 178.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.423 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 12.2 m170 -131.83 148.22 69.05 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.543 172.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -76.63 136.73 17.49 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.211 1.94 . . . . 0.0 111.577 176.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.473 ' HB2' ' CD2' ' A' ' 99' ' ' TYR . 40.3 ttpt -136.86 135.72 38.12 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.08 0.467 . . . . 0.0 110.191 177.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.792 HD21 ' HG ' ' A' ' 57' ' ' LEU . 1.0 OUTLIER -67.65 130.42 42.96 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.369 177.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 30.5 m -130.51 148.62 33.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 120.939 0.4 . . . . 0.0 110.88 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.7 p -97.64 115.08 36.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 173.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -117.89 96.17 5.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.447 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 63.56 -100.61 0.38 Allowed Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.481 -0.782 . . . . 0.0 112.827 177.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -112.18 15.16 20.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.144 0.497 . . . . 0.0 111.758 -176.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 3.1 p -143.85 149.02 36.32 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.681 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 62.6 mt -98.78 132.66 43.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 174.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -132.9 178.3 6.98 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.051 0.453 . . . . 0.0 110.699 -171.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.485 HD11 ' O ' ' A' ' 56' ' ' LYS . 40.7 mt -119.62 113.96 42.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.329 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -105.23 178.52 4.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.163 176.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.528 ' CE1' ' HB2' ' A' ' 80' ' ' LEU . 16.3 m-85 -127.59 129.16 46.8 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.636 179.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.473 ' CD2' ' HB2' ' A' ' 86' ' ' LYS . 54.0 p90 -113.17 150.78 31.76 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 174.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -65.21 129.96 41.61 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.403 -178.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 36.1 t -45.19 122.5 5.11 Favored Pre-proline 0 N--CA 1.463 0.21 0 O-C-N 123.409 0.443 . . . . 0.0 109.81 173.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.47 -30.09 86.95 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.856 2.371 . . . . 0.0 111.867 -177.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 16.9 t -66.63 -25.35 34.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.355 -178.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -61.49 -33.35 73.64 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.465 -174.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -134.18 13.49 3.89 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.751 177.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 95.3 mttt . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 114.756 -1.111 . . . . 0.0 112.441 177.317 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.613 ' O ' ' HD3' ' A' ' 3' ' ' PRO . 1.3 mpt? . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.987 0.422 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.441 ' H ' ' CD ' ' A' ' 2' ' ' GLU . 0.2 OUTLIER -107.47 88.91 4.47 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.807 -177.037 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.613 ' HD3' ' O ' ' A' ' 1' ' ' MET . 2.9 Cg_exo -73.96 65.0 5.08 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.935 2.423 . . . . 0.0 112.765 -175.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 61.8 mt -94.37 100.74 11.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -120.46 101.18 0.8 Allowed Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.132 -173.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 6' ' ' ARG . 25.5 mtp85 -96.0 34.22 1.58 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.0 0.428 . . . . 0.0 109.955 172.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.2 p -63.76 107.58 1.23 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.964 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 87.9 mt -95.1 6.09 50.02 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.108 179.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 -114.36 120.23 39.64 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.608 176.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.13 165.49 43.35 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.173 179.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.515 HG13 ' HD2' ' A' ' 15' ' ' PRO . 46.4 t -84.45 93.87 3.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 121.052 0.454 . . . . 0.0 110.269 178.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 m -87.88 104.2 16.38 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.393 177.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.489 ' O ' ' HD2' ' A' ' 14' ' ' ARG . . . 74.71 -118.32 5.71 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -173.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.489 ' HD2' ' O ' ' A' ' 13' ' ' GLY . 16.3 mmm180 -143.08 76.37 16.7 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-O 120.898 0.38 . . . . 0.0 110.683 175.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.515 ' HD2' HG13 ' A' ' 11' ' ' VAL . 72.8 Cg_endo -78.79 62.94 8.53 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.388 2.059 . . . . 0.0 111.521 173.455 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -72.51 -23.67 61.05 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.526 -178.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -64.46 -48.26 75.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.67 178.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -70.71 -32.8 70.14 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 -178.506 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.457 ' HE3' ' HB3' ' A' ' 19' ' ' LYS . 9.1 mmmt -57.74 -55.69 31.65 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.771 177.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.435 ' HA ' ' HB2' ' A' ' 23' ' ' GLN . 7.4 ptm85 -69.36 -25.73 64.33 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.381 -176.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.7 tp -68.74 -50.7 48.5 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 120.964 0.411 . . . . 0.0 111.0 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -73.05 -30.75 63.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.462 178.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.435 ' HB2' ' HA ' ' A' ' 20' ' ' ARG . 8.2 mt-30 -60.24 -57.0 14.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.768 178.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.443 ' O ' HG23 ' A' ' 28' ' ' VAL . 26.6 ptm -57.51 -43.11 83.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.095 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.8 tptp -63.07 -39.58 95.13 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.748 0.309 . . . . 0.0 110.808 177.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -61.61 -50.72 71.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.582 178.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -56.27 -48.57 76.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.969 -0.56 . . . . 0.0 112.012 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 24' ' ' MET . 89.1 t -60.43 -43.0 93.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.101 0.477 . . . . 0.0 110.569 -179.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 88.6 mtp -86.26 13.92 7.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.143 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -110.66 -34.04 6.39 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.98 0.419 . . . . 0.0 110.555 177.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.69 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 25.2 t70 -59.58 127.22 30.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.282 -174.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 -69.59 -25.4 63.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.44 -174.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -83.04 -35.96 25.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.409 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 24.2 t -57.43 -47.13 85.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.875 0.369 . . . . 0.0 110.46 171.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.69 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 47.8 mt-30 -65.24 -36.65 84.81 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.319 0.581 . . . . 0.0 110.434 179.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.55 -39.99 93.09 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.333 175.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.55 ' CD2' HD23 ' A' ' 87' ' ' LEU . 58.0 t80 -66.07 -40.66 91.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.792 176.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.454 HD13 ' HA ' ' A' ' 38' ' ' LEU . 2.1 mm? -59.79 -42.01 92.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.291 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.8 pttp -80.63 -24.11 39.26 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.118 0.485 . . . . 0.0 110.655 179.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.04 -53.24 52.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.556 0.693 . . . . 0.0 110.124 178.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -113.94 31.93 6.21 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.462 -173.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.437 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 9.8 pt-20 -62.91 -18.86 63.61 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.573 -178.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -77.71 -27.92 50.78 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.491 178.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 37.9 t -103.75 -37.18 4.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.55 -173.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.43 HD11 ' CZ ' ' A' ' 37' ' ' PHE . 74.0 mt -80.03 148.43 5.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.681 -174.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -130.06 174.5 9.73 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 174.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -59.24 -44.55 92.35 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 -175.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -67.17 -36.52 81.95 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.965 0.412 . . . . 0.0 111.149 -175.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 46.7 ttm -58.18 -38.0 75.83 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.842 174.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.2 mm -68.18 -48.48 73.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.622 176.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -53.47 -48.77 68.58 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.161 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.619 ' N ' ' HE2' ' A' ' 52' ' ' LYS . 0.8 OUTLIER -65.76 -43.25 89.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.053 -178.353 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.426 ' O ' HD13 ' A' ' 57' ' ' LEU . 8.3 m -89.95 13.02 15.75 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.189 -173.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -57.92 -33.9 69.27 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.028 0.442 . . . . 0.0 110.668 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -70.29 -37.44 74.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.585 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.456 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.6 mmmt -69.16 -42.62 75.66 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-O 120.911 0.386 . . . . 0.0 110.398 176.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.885 ' HG ' HD21 ' A' ' 87' ' ' LEU . 9.6 mp -61.78 -40.72 96.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.996 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -69.21 -44.37 72.23 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.104 0.478 . . . . 0.0 110.238 179.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -54.23 -45.85 72.39 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.778 174.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.457 ' CG ' HD13 ' A' ' 87' ' ' LEU . 32.9 t80 -60.25 -50.81 72.19 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.846 -1.07 . . . . 0.0 112.768 -178.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.469 ' O ' ' HE2' ' A' ' 65' ' ' LYS . 29.8 pt -64.82 -30.28 49.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -173.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.425 ' HG2' HG13 ' A' ' 61' ' ' ILE . 6.7 mm-40 -90.01 -29.69 18.26 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.429 HE21 ' HA ' ' A' ' 60' ' ' TYR . 22.5 pt20 -85.87 133.13 33.98 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 120.919 -0.313 . . . . 0.0 111.686 -176.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.481 ' HB3' ' HG3' ' A' ' 85' ' ' PRO . 15.2 t 49.7 40.12 19.22 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 121.287 0.565 . . . . 0.0 112.254 168.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.469 ' HE2' ' O ' ' A' ' 61' ' ' ILE . 11.8 ptpt -63.85 -24.32 67.7 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.302 0.572 . . . . 0.0 110.203 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.518 ' HA ' ' CE1' ' A' ' 84' ' ' HIS . 34.1 p30 -130.82 -170.35 2.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.026 171.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.0 p -152.58 164.1 38.31 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 176.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.523 ' HB3' ' OE2' ' A' ' 81' ' ' GLU . 31.0 t -63.48 -37.01 85.65 Favored 'General case' 0 C--N 1.317 -0.805 0 O-C-N 123.294 0.371 . . . . 0.0 110.973 -170.089 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.653 ' CZ ' ' HG3' ' A' ' 104' ' ' LYS . 2.6 t80 -55.56 -21.99 19.77 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.246 0.618 . . . . 0.0 111.935 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 30.5 p -124.28 11.57 8.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.159 0.504 . . . . 0.0 110.204 -179.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.4 ' HB3' ' HA ' ' A' ' 68' ' ' SER . 31.5 t -104.68 121.25 43.19 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.806 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -84.05 -21.9 31.42 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.805 178.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.03 137.82 32.42 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.291 174.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -83.72 -21.23 32.37 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.116 -176.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -100.27 27.95 5.3 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.052 0.453 . . . . 0.0 111.082 -172.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 31.7 t -80.65 149.94 29.62 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -102.1 112.04 24.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.862 0.363 . . . . 0.0 111.688 -176.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -176.27 149.15 0.82 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.609 173.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 5.5 mp -100.32 -41.72 6.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.184 0.516 . . . . 0.0 110.49 -177.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.438 ' HG ' ' CE2' ' A' ' 98' ' ' TYR . 3.1 mm? -72.45 112.01 8.14 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.381 -177.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.523 ' OE2' ' HB3' ' A' ' 68' ' ' SER . 4.9 tp10 -95.33 138.74 32.61 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.148 176.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 78.05 -7.66 42.68 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.367 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -125.6 153.75 43.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 117.237 0.519 . . . . 0.0 111.2 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.518 ' CE1' ' HA ' ' A' ' 66' ' ' ASN . 13.1 m170 -129.5 157.51 76.18 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 168.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.481 ' HG3' ' HB3' ' A' ' 64' ' ' SER . 73.0 Cg_endo -80.21 148.53 19.07 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.526 2.151 . . . . 0.0 111.213 176.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.632 ' HB2' ' CD1' ' A' ' 99' ' ' TYR . 20.7 ttpp -137.8 144.11 41.38 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.081 0.467 . . . . 0.0 109.874 175.332 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.885 HD21 ' HG ' ' A' ' 57' ' ' LEU . 0.8 OUTLIER -68.69 128.68 37.53 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.744 176.137 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 15.6 m -128.02 145.57 34.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.067 179.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 10.8 p -103.69 115.86 46.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.646 0.736 . . . . 0.0 109.881 174.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -114.71 95.51 5.27 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.274 179.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.53 -115.08 6.08 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.876 -176.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 24.6 mmm180 -107.05 18.61 21.54 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.069 0.461 . . . . 0.0 111.02 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 20.0 m -131.05 143.2 50.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.821 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 77.1 mt -102.18 124.15 55.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 176.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -121.62 178.33 4.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -175.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.456 HD11 ' O ' ' A' ' 56' ' ' LYS . 54.2 mt -125.02 112.57 32.17 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.707 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -126.93 158.21 37.42 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.438 ' CE2' ' HG ' ' A' ' 80' ' ' LEU . 12.9 m-85 -97.24 158.28 15.53 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -166.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.632 ' CD1' ' HB2' ' A' ' 86' ' ' LYS . 55.3 p90 -139.6 160.92 38.76 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.356 175.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -72.32 129.42 38.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.082 0.468 . . . . 0.0 111.586 -179.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 44.0 t -46.88 122.02 7.13 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.607 172.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -66.89 -22.26 49.07 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.648 2.232 . . . . 0.0 112.258 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 24.8 t -68.06 -15.96 20.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.951 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.653 ' HG3' ' CZ ' ' A' ' 69' ' ' TYR . 28.3 tttm -70.01 -21.1 63.24 Favored 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.167 0.508 . . . . 0.0 110.263 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 -83.21 39.14 0.64 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.16 -176.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 50.4 tptt . . . . . 0 N--CA 1.442 -0.865 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.721 -178.472 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.0 tpt . . . . . 0 N--CA 1.477 0.914 0 CA-C-O 120.92 0.391 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -122.81 148.04 52.61 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.537 176.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.85 146.32 79.29 Favored 'Trans proline' 0 CA--C 1.53 0.302 0 C-N-CA 122.965 2.443 . . . . 0.0 112.516 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pp -81.38 165.17 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-O 120.935 0.398 . . . . 0.0 111.567 -178.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -89.16 134.46 12.41 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.379 178.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 41.5 ttm180 -153.95 141.33 19.67 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.2 m -81.79 98.33 8.41 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.823 0.344 . . . . 0.0 110.791 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 8' ' ' LEU . 3.9 mm? -91.24 76.39 6.03 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.058 0.456 . . . . 0.0 110.319 176.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -101.69 -27.49 13.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.846 -0.615 . . . . 0.0 109.906 176.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.96 153.12 28.08 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.277 -179.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 6.4 m -74.59 93.85 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.701 0.762 . . . . 0.0 110.775 178.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.1 p -76.35 92.33 3.34 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.647 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 133.95 83.35 0.2 Allowed Glycine 0 N--CA 1.442 -0.956 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.985 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -144.32 75.57 15.17 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-O 121.717 0.77 . . . . 0.0 109.835 175.638 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.789 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 33.7 Cg_endo -66.3 144.75 75.56 Favored 'Trans proline' 0 C--O 1.234 0.314 0 C-N-CA 122.58 2.187 . . . . 0.0 112.27 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.602 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 1.5 m-20 -58.64 -37.33 75.71 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.669 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -49.5 -57.1 7.67 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.467 -178.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.789 ' HG2' ' HG2' ' A' ' 15' ' ' PRO . 1.5 pt20 -67.59 -29.65 69.05 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.463 -175.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.725 ' HE2' ' HA ' ' A' ' 19' ' ' LYS . 9.5 mmpt? -68.04 -37.72 81.67 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.864 -0.335 . . . . 0.0 111.296 -178.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.602 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 54.3 mtt180 -70.34 -40.7 73.96 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-O 121.646 0.736 . . . . 0.0 109.051 174.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.6 tp -57.11 -49.31 76.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.403 -1.271 . . . . 0.0 111.232 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 18' ' ' GLN . 11.0 mm-40 -66.14 -30.56 71.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.15 0.5 . . . . 0.0 110.536 177.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.487 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 22.5 tt0 -70.12 -53.21 18.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.794 -176.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.485 ' O ' HG23 ' A' ' 28' ' ' VAL . 25.8 ptm -67.82 -36.33 80.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.633 178.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -58.13 -42.39 85.73 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.16 0.505 . . . . 0.0 109.841 175.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.448 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 3.7 tp10 -62.58 -49.31 75.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.961 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 28.1 mmmt -54.51 -48.78 71.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.352 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 24' ' ' MET . 92.3 t -61.12 -45.18 99.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.128 -178.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.7 ptp -82.64 3.4 29.05 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.417 -176.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 13.9 mptt -106.13 -6.13 18.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.688 0.28 . . . . 0.0 110.957 177.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.691 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 15.2 t70 -85.63 129.48 34.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.676 0.274 . . . . 0.0 110.504 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -65.12 -36.74 85.22 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.466 -174.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -72.43 -38.95 68.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.979 -176.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 37.4 t -55.75 -49.97 70.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.518 174.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.691 ' HG3' ' O ' ' A' ' 31' ' ' ASP . 57.0 mt-30 -61.67 -41.02 96.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.899 -178.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.741 ' HA ' ' HE2' ' A' ' 39' ' ' LYS . . . -57.39 -42.1 81.54 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.72 176.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.501 ' CG ' ' HB3' ' A' ' 87' ' ' LEU . 54.6 t80 -69.62 -39.91 76.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.321 177.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.44 HD11 HD11 ' A' ' 50' ' ' ILE . 1.7 mm? -57.3 -43.28 83.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.41 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.741 ' HE2' ' HA ' ' A' ' 36' ' ' ALA . 52.6 pttt -83.94 -17.76 39.58 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 111.121 -179.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.83 -52.99 37.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.102 174.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -111.33 33.05 4.9 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.721 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -55.66 -33.14 63.82 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -175.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -82.09 -23.63 35.64 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.034 0.445 . . . . 0.0 111.128 -177.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 16.7 t -91.81 -41.88 13.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.193 0.521 . . . . 0.0 110.593 -175.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.423 HD11 ' CE2' ' A' ' 37' ' ' PHE . 74.1 mt -73.13 146.67 10.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.549 -178.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -120.72 161.29 21.68 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 176.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -60.61 -37.85 82.75 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.919 176.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.571 ' O ' ' HG2' ' A' ' 52' ' ' LYS . 13.3 mmmm -63.64 -37.54 87.71 Favored 'General case' 0 C--O 1.224 -0.286 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.172 175.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.547 ' HG2' HG13 ' A' ' 94' ' ' ILE . 46.6 ttm -64.0 -32.38 73.91 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.454 177.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.44 HD11 HD11 ' A' ' 38' ' ' LEU . 35.5 mm -62.3 -54.44 34.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.331 -179.511 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 2.0 pt-20 -60.81 -47.1 87.89 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.842 0.353 . . . . 0.0 111.757 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 48' ' ' LYS . 74.4 mmtt -55.87 -48.08 76.2 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.383 0.611 . . . . 0.0 110.536 178.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.533 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 5.4 m -94.37 13.61 23.13 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.565 -173.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -54.44 -47.85 72.4 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-O 121.537 0.684 . . . . 0.0 110.265 178.81 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 51.1 m-80 -56.22 -40.84 74.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.446 -1.252 . . . . 0.0 110.735 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.527 ' O ' HD11 ' A' ' 96' ' ' ILE . 13.6 mmmm -70.18 -44.04 69.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.994 -179.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 53' ' ' SER . 75.1 mt -62.74 -38.88 92.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.24 0.543 . . . . 0.0 110.187 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -69.74 -41.43 75.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.249 177.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.06 -37.78 80.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.012 0.434 . . . . 0.0 110.511 176.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.47 ' CD1' HD13 ' A' ' 87' ' ' LEU . 89.1 t80 -56.38 -50.51 71.34 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.105 177.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 32.2 pt -75.49 -29.71 21.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.812 -178.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -66.42 -46.75 75.46 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.517 177.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -65.81 -175.16 0.27 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.85 -0.613 . . . . 0.0 112.11 -177.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.796 ' HB3' ' HA ' ' A' ' 78' ' ' ASN . 2.9 p -59.92 102.6 0.16 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.193 179.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -68.88 -33.1 73.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.469 0.652 . . . . 0.0 110.349 -178.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -124.94 -156.2 0.71 Allowed 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 173.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.682 ' HA ' ' OD1' ' A' ' 78' ' ' ASN . 0.5 OUTLIER -148.53 152.1 36.26 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 119.659 -0.816 . . . . 0.0 109.843 174.536 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.654 ' HA ' ' O ' ' A' ' 71' ' ' SER . 0.7 OUTLIER -74.68 -23.34 58.61 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.405 -169.951 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.404 ' HB3' ' SG ' ' A' ' 67' ' ' CYS . 13.8 t80 -58.26 -20.65 43.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.153 176.17 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 24.3 p -118.27 -47.05 2.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.967 0.413 . . . . 0.0 110.862 176.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.654 ' O ' ' HA ' ' A' ' 68' ' ' SER . 8.6 m -100.85 118.37 36.77 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.722 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -83.44 56.57 3.63 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.755 0.788 . . . . 0.0 110.18 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -85.43 122.58 29.78 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.939 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -75.74 -15.43 60.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.181 -0.463 . . . . 0.0 112.037 -173.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -119.15 -2.73 10.68 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -174.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 44.7 t -73.18 114.11 11.0 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.893 0.378 . . . . 0.0 110.433 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -77.31 115.59 17.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.886 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.796 ' HA ' ' HB3' ' A' ' 64' ' ' SER . 10.6 m-80 -111.34 132.46 54.39 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.401 -176.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.405 HD22 ' N ' ' A' ' 79' ' ' LEU . 3.1 mm? -89.6 -79.25 0.34 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.811 -0.632 . . . . 0.0 109.331 176.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.452 ' HB3' ' HD2' ' A' ' 83' ' ' TYR . 7.2 mp -87.35 88.39 7.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.062 175.138 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -64.27 144.4 57.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.66 -179.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.21 -8.1 72.46 Favored Glycine 0 N--CA 1.445 -0.752 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.201 -177.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.452 ' HD2' ' HB3' ' A' ' 80' ' ' LEU . 61.2 m-85 -121.58 167.34 13.0 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 178.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 16.0 m170 -131.85 145.69 58.58 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 172.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -79.67 135.29 11.46 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 122.414 2.076 . . . . 0.0 111.709 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.66 139.68 53.35 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.309 0.576 . . . . 0.0 109.784 173.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.516 HD21 HD22 ' A' ' 57' ' ' LEU . 1.1 tp -77.39 131.52 38.08 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.054 -179.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.453 ' CG2' ' HB3' ' A' ' 95' ' ' ASP . 30.0 m -136.31 170.0 19.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 6.3 p -112.92 114.52 47.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.368 0.604 . . . . 0.0 110.27 175.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -121.14 107.96 13.22 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.644 -178.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 75.26 -112.47 3.65 Favored Glycine 0 N--CA 1.444 -0.784 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.396 -178.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.433 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 30.7 mmt180 -117.92 12.01 13.63 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.167 0.508 . . . . 0.0 109.932 177.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 38.1 p -128.36 150.79 49.94 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.078 -177.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.547 HG13 ' HG2' ' A' ' 49' ' ' MET . 77.9 mt -86.38 131.91 33.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 176.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.453 ' HB3' ' CG2' ' A' ' 88' ' ' VAL . 13.6 t0 -119.5 169.26 10.2 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.932 -170.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.527 HD11 ' O ' ' A' ' 56' ' ' LYS . 60.5 mt -126.86 113.93 35.14 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.908 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -118.14 159.93 22.43 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 175.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -108.84 129.0 55.39 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.176 0.513 . . . . 0.0 111.527 -176.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 45.8 p90 -108.69 153.84 22.87 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -73.41 135.54 44.21 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.541 -176.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.575 ' SG ' HG12 ' A' ' 103' ' ' VAL . 47.7 t -45.3 126.3 5.86 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.802 179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.51 -13.65 22.05 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.364 2.709 . . . . 0.0 113.885 -176.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.575 HG12 ' SG ' ' A' ' 101' ' ' CYS . 9.9 p -66.9 -23.08 30.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 121.041 0.448 . . . . 0.0 110.348 178.213 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 9.0 mmmm -65.83 -28.96 69.37 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.578 0.704 . . . . 0.0 109.85 174.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 105' ' ' ARG . 4.1 mmp_? -104.58 14.57 29.67 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.176 178.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 63.8 pttt . . . . . 0 N--CA 1.466 0.356 0 CA-C-N 114.207 -1.36 . . . . 0.0 112.113 -175.441 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.1 ttt . . . . . 0 N--CA 1.483 1.177 0 CA-C-O 120.744 0.306 . . . . 0.0 110.689 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.486 ' CD ' ' H ' ' A' ' 2' ' ' GLU . 1.2 pm0 -72.4 147.64 90.2 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 175.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.91 99.04 0.38 Allowed 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.498 2.132 . . . . 0.0 112.903 -176.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 39.5 mm -87.98 76.36 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -135.07 117.57 1.76 Allowed Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.761 -175.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -123.97 2.48 8.69 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.283 0.563 . . . . 0.0 109.826 174.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.2 m -86.73 14.17 7.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.914 -177.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.5 mp -67.15 -40.63 86.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.704 -179.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 81.2 mm-40 -129.86 -61.15 1.01 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.373 0.606 . . . . 0.0 110.395 -179.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 143.36 -96.6 0.19 Allowed Glycine 0 N--CA 1.446 -0.688 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.209 -177.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 38.4 t -103.98 94.51 3.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 121.121 0.486 . . . . 0.0 109.916 177.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.0 t -164.29 154.27 14.39 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.229 178.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.44 ' O ' ' HD3' ' A' ' 14' ' ' ARG . . . 76.4 104.13 0.14 Allowed Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.89 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.44 ' HD3' ' O ' ' A' ' 13' ' ' GLY . 57.9 mmt-85 -142.25 67.88 21.39 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-O 120.924 0.392 . . . . 0.0 110.38 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.647 ' HG2' ' HG2' ' A' ' 18' ' ' GLN . 71.9 Cg_endo -84.0 103.5 1.01 Allowed 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.336 2.024 . . . . 0.0 111.138 174.403 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.697 ' O ' ' HG3' ' A' ' 20' ' ' ARG . 0.5 OUTLIER -65.47 -21.37 66.63 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 121.034 -0.266 . . . . 0.0 110.635 -175.725 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -55.96 -50.95 69.38 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.332 175.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.647 ' HG2' ' HG2' ' A' ' 15' ' ' PRO . 0.0 OUTLIER -69.04 -30.67 69.08 Favored 'General case' 0 C--O 1.226 -0.179 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -178.781 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 23' ' ' GLN . 29.5 mmmt -60.33 -47.74 84.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.354 -179.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.697 ' HG3' ' O ' ' A' ' 16' ' ' ASP . 14.0 mtm-85 -71.06 -53.31 15.15 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.1 -51.11 70.61 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.791 -1.095 . . . . 0.0 112.506 -174.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -75.98 -28.28 57.78 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 -176.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 19' ' ' LYS . 8.9 tt0 -64.45 -55.84 18.2 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.079 176.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.604 ' O ' HG23 ' A' ' 28' ' ' VAL . 27.6 ptm -62.0 -40.78 96.83 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.72 179.288 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.425 ' HA ' HD21 ' A' ' 54' ' ' LEU . 80.8 tttt -62.8 -42.58 99.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.43 -178.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.494 ' O ' ' HD3' ' A' ' 30' ' ' LYS . 14.3 tt0 -62.68 -45.97 90.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.864 0.364 . . . . 0.0 110.106 177.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.0 mtpt -55.46 -45.21 76.9 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.456 179.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 24' ' ' MET . 72.1 t -61.77 -42.42 94.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.678 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 21.8 ptp -84.77 14.61 4.57 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.943 -0.303 . . . . 0.0 111.29 -177.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.494 ' HD3' ' O ' ' A' ' 26' ' ' GLU . 2.4 mptm? -115.25 -14.83 11.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.059 176.092 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.639 ' O ' ' HG2' ' A' ' 35' ' ' GLN . 19.6 t70 -74.16 135.33 42.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.069 0.461 . . . . 0.0 110.662 -177.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -66.72 -36.67 83.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.965 -175.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -75.3 -35.86 61.22 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.017 0.437 . . . . 0.0 110.065 -178.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.1 t -59.66 -41.01 83.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.487 174.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.639 ' HG2' ' O ' ' A' ' 31' ' ' ASP . 74.1 mm-40 -57.15 -49.03 77.2 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.139 0.495 . . . . 0.0 110.04 176.225 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 40' ' ' GLU . . . -56.14 -40.54 73.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.476 -179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -66.32 -43.54 85.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.809 0.337 . . . . 0.0 110.981 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.526 HD11 HD11 ' A' ' 50' ' ' ILE . 3.5 mm? -63.02 -43.25 99.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.824 -177.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -70.77 -32.62 69.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.188 0.518 . . . . 0.0 110.721 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 0.3 OUTLIER -74.36 -29.57 61.62 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.333 -177.727 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -118.27 28.54 8.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.184 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -63.34 -16.95 61.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.608 0.718 . . . . 0.0 109.931 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -73.89 -25.84 60.23 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.908 179.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.9 t -119.96 -33.73 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -170.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.515 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 73.1 mt -71.8 143.83 13.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.358 0.599 . . . . 0.0 112.203 -172.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -120.1 166.65 13.12 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.91 177.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -62.52 -41.64 98.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.333 0.587 . . . . 0.0 109.588 174.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -63.89 -37.64 88.15 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.618 -179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.515 ' SD ' ' HA ' ' A' ' 45' ' ' ILE . 54.0 ttm -58.56 -39.44 80.27 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.551 176.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.526 HD11 HD11 ' A' ' 38' ' ' LEU . 46.6 mm -67.29 -48.31 78.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.742 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -61.78 -37.77 85.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.288 -178.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.473 ' C ' ' HD3' ' A' ' 52' ' ' LYS . 1.1 tmtp? -71.7 -45.99 60.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.386 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.407 ' O ' ' HG ' ' A' ' 57' ' ' LEU . 10.8 m -92.46 16.55 11.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.452 -173.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -56.52 -40.07 74.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.255 0.55 . . . . 0.0 110.383 178.934 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 9.0 p30 -62.1 -45.67 92.44 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.462 177.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.467 ' O ' HD11 ' A' ' 96' ' ' ILE . 31.6 mmmt -64.88 -49.57 69.99 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.891 0.377 . . . . 0.0 110.752 179.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.413 ' CD2' ' HG ' ' A' ' 87' ' ' LEU . 90.0 mt -60.76 -39.12 87.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.886 -178.239 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 40.9 t80 -69.9 -43.08 72.48 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.696 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -61.2 -31.74 71.5 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.336 0.589 . . . . 0.0 109.839 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.477 ' HE1' ' O ' ' A' ' 85' ' ' PRO . 34.4 t80 -66.4 -46.23 77.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.189 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' A' ' 28' ' ' VAL . 31.2 pt -75.5 -29.01 20.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -176.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -74.23 -35.62 63.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.533 179.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 60' ' ' TYR . 10.1 pt20 -75.4 -175.76 2.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.027 0.441 . . . . 0.0 111.016 -178.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 44.0 t -71.35 93.71 1.16 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.299 177.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -73.83 -26.98 60.88 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.29 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -96.09 -172.75 2.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.441 177.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.579 ' HA ' ' ND2' ' A' ' 78' ' ' ASN . 0.8 OUTLIER -141.56 154.21 45.31 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.602 179.573 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 71' ' ' SER . 17.5 m -72.4 -11.06 60.53 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.847 -173.23 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -79.5 -3.56 47.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.093 0.473 . . . . 0.0 110.584 176.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 26.0 p -132.42 -27.55 1.75 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.153 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.513 ' O ' ' HA ' ' A' ' 68' ' ' SER . 19.2 m -114.52 115.8 27.8 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 175.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -76.21 -29.25 57.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -173.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -62.86 131.43 48.76 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.586 0.708 . . . . 0.0 110.98 -169.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 36.5 mp0 -62.99 -22.45 66.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.739 -172.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 34.6 m-80 -64.77 -22.19 66.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.959 0.409 . . . . 0.0 110.967 -177.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 53.1 m -111.01 25.98 11.19 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.999 -178.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.2 p30 -63.58 143.96 57.4 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.158 0.504 . . . . 0.0 110.641 -179.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.579 ' ND2' ' HA ' ' A' ' 67' ' ' CYS . 0.3 OUTLIER -135.61 139.14 43.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.862 -177.046 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.498 ' HG ' ' N ' ' A' ' 80' ' ' LEU . 2.5 pt? -59.72 -52.26 66.25 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.216 -179.357 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.517 ' HG ' ' HB2' ' A' ' 83' ' ' TYR . 12.8 tp -86.93 74.74 9.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.304 0.574 . . . . 0.0 109.934 177.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -72.43 146.69 46.78 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.714 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.56 -8.94 76.64 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.606 -179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' TYR . . . . . 0.517 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . 47.8 m-85 -123.65 164.84 18.27 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.484 ' O ' ' HA ' ' A' ' 98' ' ' TYR . 12.6 m170 -128.33 146.79 61.08 Favored Pre-proline 0 CA--C 1.509 -0.616 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 172.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.539 ' HA ' ' O ' ' A' ' 97' ' ' GLU . 56.5 Cg_endo -75.55 138.47 21.78 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.114 1.876 . . . . 0.0 111.064 172.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.439 ' HD2' ' HD1' ' A' ' 99' ' ' TYR . 0.0 OUTLIER -142.3 153.07 43.58 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.082 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.418 ' CD1' HG12 ' A' ' 96' ' ' ILE . 2.2 mm? -79.21 147.3 32.66 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.882 0.372 . . . . 0.0 110.517 -177.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 25.3 m -131.37 135.63 59.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.633 174.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 3.1 p -90.38 114.62 28.28 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-O 121.098 0.475 . . . . 0.0 110.832 -179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -119.38 95.74 4.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.494 178.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.74 -123.93 7.73 Favored Glycine 0 N--CA 1.446 -0.663 0 N-CA-C 110.554 -1.018 . . . . 0.0 110.554 -174.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.5 mpp_? -103.77 10.44 36.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.957 0.408 . . . . 0.0 110.33 173.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 24.8 m -116.11 135.91 53.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.622 -179.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 78.1 mt -101.84 133.44 45.33 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.385 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.421 ' HA ' ' HE2' ' A' ' 56' ' ' LYS . 3.6 t70 -118.0 178.6 4.36 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -177.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.467 HD11 ' O ' ' A' ' 56' ' ' LYS . 53.3 mt -127.31 113.39 31.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-O 120.705 0.288 . . . . 0.0 110.944 -176.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.539 ' O ' ' HA ' ' A' ' 85' ' ' PRO . 29.8 mm-40 -113.86 -173.89 2.36 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.01 179.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.484 ' HA ' ' O ' ' A' ' 84' ' ' HIS . 10.3 m-85 -128.82 150.11 50.46 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.016 0.436 . . . . 0.0 111.926 -177.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.439 ' HD1' ' HD2' ' A' ' 86' ' ' LYS . 53.3 p90 -136.46 158.13 45.16 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.088 174.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -71.74 132.59 44.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.376 0.608 . . . . 0.0 111.862 -177.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 33.7 t -57.88 122.6 58.52 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.192 173.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -63.65 -23.14 70.07 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.419 2.079 . . . . 0.0 112.301 178.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.744 ' HA ' ' HG3' ' A' ' 106' ' ' LYS . 44.8 t -64.93 -19.74 26.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 121.239 0.542 . . . . 0.0 110.823 178.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.641 ' HD3' ' O ' ' A' ' 104' ' ' LYS . 1.0 OUTLIER -64.51 -23.98 67.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.065 178.471 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -131.57 35.72 3.81 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.148 0.499 . . . . 0.0 111.107 -172.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.744 ' HG3' ' HA ' ' A' ' 103' ' ' VAL . 9.2 mtpm? . . . . . 0 C--O 1.237 0.445 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.47 174.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_